(phenylmethyl) 6-(4-tert-butylphenyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate

Systemtic Name: (phenylmethyl) 6-(4-tert-butylphenyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate Openeye Name: benzyl 6-(4-tert-butylphenyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate CAS Name: 6-(4-tert-butylphenyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(4-tert-butylphenyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid benzyl ester Formula: C30H31NO2 MolecularWeight: 437.57264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC3=C(C=C2)NC4=C3CC(CC4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC3=C(C=C2)NC4=C3CC(CC4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H31NO2/c1-30(2,3)24-13-9-21(10-14-24)22-11-15-27-25(17-22)26-18-23(12-16-28(26)31-27)29(32)33-19-20-7-5-4-6-8-20/h4-11,13-15,17,23,31H,12,16,18-19H2,1-3H3