methyl 2-methyl-5-oxidanyl-1-[(4-propan-2-ylphenyl)methyl]benzo[g]indole-3-carboxylate

Systemtic Name: methyl 2-methyl-5-oxidanyl-1-[(4-propan-2-ylphenyl)methyl]benzo[g]indole-3-carboxylate Openeye Name: methyl 5-hydroxy-1-[(4-isopropylphenyl)methyl]-2-methyl-benzo[g]indole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-1-[(4-propan-2-ylphenyl)methyl]-3-benzo[g]indolecarboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-2-methyl-1-[(4-propan-2-ylphenyl)methyl]benzo[g]indole-3-carboxylate Traditional Name: 5-hydroxy-1-(4-isopropylbenzyl)-2-methyl-benz[g]indole-3-carboxylic acid methyl ester Formula: C25H25NO3 MolecularWeight: 387.4709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)C(C)C)C4=CC=CC=C4C(=C2)O)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)C(C)C)C4=CC=CC=C4C(=C2)O)C(=O)OC

InChI

InChI=1S/C25H25NO3/c1-15(2)18-11-9-17(10-12-18)14-26-16(3)23(25(28)29-4)21-13-22(27)19-7-5-6-8-20(19)24(21)26/h5-13,15,27H,14H2,1-4H3