(phenylmethyl) 9-(3-methoxyphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-3-carboxylate

Systemtic Name: (phenylmethyl) 9-(3-methoxyphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-3-carboxylate Openeye Name: benzyl 9-(3-methoxybenzoyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylate CAS Name: 9-[(3-methoxyphenyl)-oxomethyl]-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-(3-methoxybenzoyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylate Traditional Name: 9-m-anisoyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid benzyl ester Formula: C28H25NO4 MolecularWeight: 439.5024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2C3=C(CC(CC3)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C52

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2C3=C(CC(CC3)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C52

InChI

InChI=1S/C28H25NO4/c1-32-22-11-7-10-20(16-22)27(30)29-25-13-6-5-12-23(25)24-17-21(14-15-26(24)29)28(31)33-18-19-8-3-2-4-9-19/h2-13,16,21H,14-15,17-18H2,1H3