1-azanyl-4-[(3-methylphenyl)amino]-2-pyrrolidin-1-yl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-[(3-methylphenyl)amino]-2-pyrrolidin-1-yl-anthracene-9,10-dione Openeye Name: 1-amino-4-(3-methylanilino)-2-pyrrolidin-1-yl-anthracene-9,10-dione CAS Name: 1-amino-4-(3-methylanilino)-2-(1-pyrrolidinyl)anthracene-9,10-dione IUPAC Name: 1-amino-4-(3-methylanilino)-2-pyrrolidin-1-ylanthracene-9,10-dione Traditional Name: 1-amino-4-(m-toluidino)-2-pyrrolidino-9,10-anthraquinone Formula: C25H23N3O2 MolecularWeight: 397.46902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C3C(=C(C(=C2)N4CCCC4)N)C(=O)C5=CC=CC=C5C3=O

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C3C(=C(C(=C2)N4CCCC4)N)C(=O)C5=CC=CC=C5C3=O

InChI

InChI=1S/C25H23N3O2/c1-15-7-6-8-16(13-15)27-19-14-20(28-11-4-5-12-28)23(26)22-21(19)24(29)17-9-2-3-10-18(17)25(22)30/h2-3,6-10,13-14,27H,4-5,11-12,26H2,1H3