1-[[3-(dimethylamino)-4-phenyl-butyl]amino]-4-(propan-2-ylamino)anthracene-9,10-dione

Systemtic Name: 1-[[3-(dimethylamino)-4-phenyl-butyl]amino]-4-(propan-2-ylamino)anthracene-9,10-dione Openeye Name: 1-[[3-(dimethylamino)-4-phenyl-butyl]amino]-4-(isopropylamino)anthracene-9,10-dione CAS Name: 1-[[3-(dimethylamino)-4-phenylbutyl]amino]-4-(propan-2-ylamino)anthracene-9,10-dione IUPAC Name: 1-[[3-(dimethylamino)-4-phenylbutyl]amino]-4-(propan-2-ylamino)anthracene-9,10-dione Traditional Name: 1-[[3-(dimethylamino)-4-phenyl-butyl]amino]-4-(isopropylamino)-9,10-anthraquinone Formula: C29H33N3O2 MolecularWeight: 455.59122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C2C(=C(C=C1)NCCC(CC3=CC=CC=C3)N(C)C)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

CC(C)NC1=C2C(=C(C=C1)NCCC(CC3=CC=CC=C3)N(C)C)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C29H33N3O2/c1-19(2)31-25-15-14-24(26-27(25)29(34)23-13-9-8-12-22(23)28(26)33)30-17-16-21(32(3)4)18-20-10-6-5-7-11-20/h5-15,19,21,30-31H,16-18H2,1-4H3