(2Z)-2-[azanyl(oxidanyl)methylidene]-9-[(2-azanylpropylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione

Systemtic Name: (2Z)-2-[azanyl(oxidanyl)methylidene]-9-[(2-azanylpropylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Openeye Name: (2Z)-2-[amino(hydroxy)methylene]-9-[(2-aminopropylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione CAS Name: (2Z)-2-[amino(hydroxy)methylidene]-9-[(2-aminopropylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione IUPAC Name: (2Z)-2-[amino(hydroxy)methylidene]-9-[(2-aminopropylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Traditional Name: (2Z)-2-[amino(hydroxy)methylene]-9-[(2-aminopropylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Formula: C27H37N5O7 MolecularWeight: 543.61198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC1=CC(=C2CC3CC4C(C(=O)C(=C(N)O)C(=O)C4(C(=O)C3=C(C2=C1O)O)O)N(C)C)N(C)C)N

Isomeric SMILES

CC(CNCC1=CC(=C2CC3CC4C(C(=O)/C(=C(\N)/O)/C(=O)C4(C(=O)C3=C(C2=C1O)O)O)N(C)C)N(C)C)N

InChI

InChI=1S/C27H37N5O7/c1-11(28)9-30-10-13-8-16(31(2)3)14-6-12-7-15-20(32(4)5)23(35)19(26(29)38)25(37)27(15,39)24(36)17(12)22(34)18(14)21(13)33/h8,11-12,15,20,30,33-34,38-39H,6-7,9-10,28-29H2,1-5H3/b26-19-