tert-butyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-methanoyl-indol-1-yl]methyl]-3-methoxy-benzoate

Systemtic Name: tert-butyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-methanoyl-indol-1-yl]methyl]-3-methoxy-benzoate Openeye Name: tert-butyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-formyl-indol-1-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[6-[(cyclopentylmethylamino)-oxomethyl]-3-formyl-1-indolyl]methyl]-3-methoxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-formylindol-1-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[6-(cyclopentylmethylcarbamoyl)-3-formyl-indol-1-yl]methyl]-3-methoxy-benzoic acid tert-butyl ester Formula: C29H34N2O5 MolecularWeight: 490.59066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)CN2C=C(C3=C2C=C(C=C3)C(=O)NCC4CCCC4)C=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)CN2C=C(C3=C2C=C(C=C3)C(=O)NCC4CCCC4)C=O)OC

InChI

InChI=1S/C29H34N2O5/c1-29(2,3)36-28(34)21-9-10-22(26(14-21)35-4)16-31-17-23(18-32)24-12-11-20(13-25(24)31)27(33)30-15-19-7-5-6-8-19/h9-14,17-19H,5-8,15-16H2,1-4H3,(H,30,33)