8-methoxy-5-methyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]pyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 8-methoxy-5-methyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]pyrimido[5,4-b]indole-2,4-dione Openeye Name: 8-methoxy-5-methyl-3-(m-tolyl)-1-(m-tolylmethyl)pyrimido[5,4-b]indole-2,4-dione CAS Name: 8-methoxy-5-methyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]pyrimido[5,4-b]indole-2,4-dione IUPAC Name: 8-methoxy-5-methyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]pyrimido[5,4-b]indole-2,4-dione Traditional Name: 8-methoxy-5-methyl-1-(3-methylbenzyl)-3-(m-tolyl)pyrimid[5,4-b]indole-2,4-quinone Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C3=C(C(=O)N(C2=O)C4=CC=CC(=C4)C)N(C5=C3C=C(C=C5)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C3=C(C(=O)N(C2=O)C4=CC=CC(=C4)C)N(C5=C3C=C(C=C5)OC)C

InChI

InChI=1S/C27H25N3O3/c1-17-7-5-9-19(13-17)16-29-24-22-15-21(33-4)11-12-23(22)28(3)25(24)26(31)30(27(29)32)20-10-6-8-18(2)14-20/h5-15H,16H2,1-4H3