1-(8-methoxy-5,7-dinitro-quinolin-2-yl)-4-methyl-9-(phenylmethyl)pyrido[3,4-b]indole

Systemtic Name: 1-(8-methoxy-5,7-dinitro-quinolin-2-yl)-4-methyl-9-(phenylmethyl)pyrido[3,4-b]indole Openeye Name: 9-benzyl-1-(8-methoxy-5,7-dinitro-2-quinolyl)-4-methyl-pyrido[3,4-b]indole CAS Name: 1-(8-methoxy-5,7-dinitro-2-quinolinyl)-4-methyl-9-(phenylmethyl)pyrido[3,4-b]indole IUPAC Name: 9-benzyl-1-(8-methoxy-5,7-dinitroquinolin-2-yl)-4-methylpyrido[3,4-b]indole Traditional Name: 9-benzyl-1-(8-methoxy-5,7-dinitro-2-quinolyl)-4-methyl-$b-carboline Formula: C29H21N5O5 MolecularWeight: 519.50754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C2=C1C3=CC=CC=C3N2CC4=CC=CC=C4)C5=NC6=C(C=C5)C(=CC(=C6OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(C2=C1C3=CC=CC=C3N2CC4=CC=CC=C4)C5=NC6=C(C=C5)C(=CC(=C6OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C29H21N5O5/c1-17-15-30-27(21-13-12-20-23(33(35)36)14-24(34(37)38)29(39-2)26(20)31-21)28-25(17)19-10-6-7-11-22(19)32(28)16-18-8-4-3-5-9-18/h3-15H,16H2,1-2H3