N-[(9Z)-9-[azanyl(oxidanyl)methylidene]-7-(dimethylamino)-1,10a,12-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-[3-(dimethylamino)pyrrolidin-1-yl]propanamide dihydrochloride

Systemtic Name: N-[(9Z)-9-[azanyl(oxidanyl)methylidene]-7-(dimethylamino)-1,10a,12-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-[3-(dimethylamino)pyrrolidin-1-yl]propanamide dihydrochloride Openeye Name: N-[(9Z)-9-[amino(hydroxy)methylene]-7-(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-[3-(dimethylamino)pyrrolidin-1-yl]propanamide dihydrochloride CAS Name: N-[(9Z)-9-[amino(hydroxy)methylidene]-7-(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-[3-(dimethylamino)-1-pyrrolidinyl]propanamide dihydrochloride IUPAC Name: N-[(9Z)-9-[amino(hydroxy)methylidene]-7-(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-[3-(dimethylamino)pyrrolidin-1-yl]propanamide dihydrochloride Traditional Name: N-[(9Z)-9-[amino(hydroxy)methylene]-7-(dimethylamino)-1,10a,12-trihydroxy-8,10,11-triketo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-[3-(dimethylamino)pyrrolidino]propionamide dihydrochloride Formula: C30H41Cl2N5O8 MolecularWeight: 670.58124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(CC3CC4C(C(=O)C(=C(N)O)C(=O)C4(C(=O)C3=C2O)O)N(C)C)C=C1)O)N5CCC(C5)N(C)C.Cl.Cl

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(CC3CC4C(C(=O)/C(=C(\N)/O)/C(=O)C4(C(=O)C3=C2O)O)N(C)C)C=C1)O)N5CCC(C5)N(C)C.Cl.Cl

InChI

InChI=1S/C30H39N5O8.2ClH/c1-13(35-9-8-16(12-35)33(2)3)29(42)32-18-7-6-14-10-15-11-17-22(34(4)5)25(38)21(28(31)41)27(40)30(17,43)26(39)20(15)24(37)19(14)23(18)36;;/h6-7,13,15-17,22,36-37,41,43H,8-12,31H2,1-5H3,(H,32,42);2*1H/b28-21-;;