1,5-bis(azanyl)-7-(4-butoxyphenyl)-2-chloranyl-4,8-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 1,5-bis(azanyl)-7-(4-butoxyphenyl)-2-chloranyl-4,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 1,5-diamino-7-(4-butoxyphenyl)-2-chloro-4,8-dihydroxy-anthracene-9,10-dione CAS Name: 1,5-diamino-7-(4-butoxyphenyl)-2-chloro-4,8-dihydroxyanthracene-9,10-dione IUPAC Name: 1,5-diamino-7-(4-butoxyphenyl)-2-chloro-4,8-dihydroxyanthracene-9,10-dione Traditional Name: 1,5-diamino-7-(4-butoxyphenyl)-2-chloro-4,8-dihydroxy-9,10-anthraquinone Formula: C24H21ClN2O5 MolecularWeight: 452.88694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C3=O)C(=CC(=C4N)Cl)O)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C3=O)C(=CC(=C4N)Cl)O)N

InChI

InChI=1S/C24H21ClN2O5/c1-2-3-8-32-12-6-4-11(5-7-12)13-9-15(26)17-20(22(13)29)24(31)19-18(23(17)30)16(28)10-14(25)21(19)27/h4-7,9-10,28-29H,2-3,8,26-27H2,1H3