9-[(4-tert-butylphenyl)methyl]-6-(3-methylphenyl)-1H-pyrano[3,4-b]indole-3,4-dione

Systemtic Name: 9-[(4-tert-butylphenyl)methyl]-6-(3-methylphenyl)-1H-pyrano[3,4-b]indole-3,4-dione Openeye Name: 9-[(4-tert-butylphenyl)methyl]-6-(m-tolyl)-1H-pyrano[3,4-b]indole-3,4-dione CAS Name: 9-[(4-tert-butylphenyl)methyl]-6-(3-methylphenyl)-1H-pyrano[3,4-b]indole-3,4-dione IUPAC Name: 9-[(4-tert-butylphenyl)methyl]-6-(3-methylphenyl)-1H-pyrano[3,4-b]indole-3,4-dione Traditional Name: 9-(4-tert-butylbenzyl)-6-(m-tolyl)-1H-pyran[3,4-b]indole-3,4-quinone Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC3=C(C=C2)N(C4=C3C(=O)C(=O)OC4)CC5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC3=C(C=C2)N(C4=C3C(=O)C(=O)OC4)CC5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C29H27NO3/c1-18-6-5-7-20(14-18)21-10-13-24-23(15-21)26-25(17-33-28(32)27(26)31)30(24)16-19-8-11-22(12-9-19)29(2,3)4/h5-15H,16-17H2,1-4H3