methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-(hydroxymethyl)indol-1-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-(hydroxymethyl)indol-1-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-(hydroxymethyl)indol-1-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[6-[(cyclopentylmethylamino)-oxomethyl]-3-(hydroxymethyl)-1-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-(hydroxymethyl)indol-1-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[6-(cyclopentylmethylcarbamoyl)-3-methylol-indol-1-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CN2C=C(C3=C2C=C(C=C3)C(=O)NCC4CCCC4)CO

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CN2C=C(C3=C2C=C(C=C3)C(=O)NCC4CCCC4)CO

InChI

InChI=1S/C26H30N2O5/c1-32-24-12-19(26(31)33-2)7-8-20(24)14-28-15-21(16-29)22-10-9-18(11-23(22)28)25(30)27-13-17-5-3-4-6-17/h7-12,15,17,29H,3-6,13-14,16H2,1-2H3,(H,27,30)