(2Z)-4-azanyl-2-[azanyl(oxidanyl)methylidene]-4-[2-(diethylamino)ethanoyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydrotetracene-1,3,12-trione hydrochloride

Systemtic Name: (2Z)-4-azanyl-2-[azanyl(oxidanyl)methylidene]-4-[2-(diethylamino)ethanoyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydrotetracene-1,3,12-trione hydrochloride Openeye Name: (2Z)-4-amino-2-[amino(hydroxy)methylene]-4-[2-(diethylamino)acetyl]-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydrotetracene-1,3,12-trione hydrochloride CAS Name: (2Z)-4-amino-2-[amino(hydroxy)methylidene]-4-[2-(diethylamino)-1-oxoethyl]-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydrotetracene-1,3,12-trione hydrochloride IUPAC Name: (2Z)-4-amino-2-[amino(hydroxy)methylidene]-4-[2-(diethylamino)acetyl]-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydrotetracene-1,3,12-trione hydrochloride Traditional Name: (2Z)-4-amino-2-[amino(hydroxy)methylene]-4-[2-(diethylamino)acetyl]-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydrotetracene-1,3,12-trione hydrochloride Formula: C25H30ClN3O8 MolecularWeight: 535.974

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)C1(C2CC3CC4=C(C(=CC=C4)O)C(=C3C(=O)C2(C(=O)C(=C(N)O)C1=O)O)O)N.Cl

Isomeric SMILES

CCN(CC)CC(=O)C1(C2CC3CC4=C(C(=CC=C4)O)C(=C3C(=O)C2(C(=O)/C(=C(/N)\O)/C1=O)O)O)N.Cl

InChI

InChI=1S/C25H29N3O8.ClH/c1-3-28(4-2)10-15(30)24(27)14-9-12-8-11-6-5-7-13(29)16(11)19(31)17(12)21(33)25(14,36)22(34)18(20(24)32)23(26)35;/h5-7,12,14,29,31,35-36H,3-4,8-10,26-27H2,1-2H3;1H/b23-18-;