4-[[3-(cyclopentylmethyl)-6-(2-ethylbutylcarbamoyl)indol-1-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[3-(cyclopentylmethyl)-6-(2-ethylbutylcarbamoyl)indol-1-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[3-(cyclopentylmethyl)-6-(2-ethylbutylcarbamoyl)indol-1-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[3-(cyclopentylmethyl)-6-[(2-ethylbutylamino)-oxomethyl]-1-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[3-(cyclopentylmethyl)-6-(2-ethylbutylcarbamoyl)indol-1-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[3-(cyclopentylmethyl)-6-(2-ethylbutylcarbamoyl)indol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C30H38N2O4 MolecularWeight: 490.63372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC(=O)C1=CC2=C(C=C1)C(=CN2CC3=C(C=C(C=C3)C(=O)O)OC)CC4CCCC4

Isomeric SMILES

CCC(CC)CNC(=O)C1=CC2=C(C=C1)C(=CN2CC3=C(C=C(C=C3)C(=O)O)OC)CC4CCCC4

InChI

InChI=1S/C30H38N2O4/c1-4-20(5-2)17-31-29(33)22-12-13-26-25(14-21-8-6-7-9-21)19-32(27(26)15-22)18-24-11-10-23(30(34)35)16-28(24)36-3/h10-13,15-16,19-21H,4-9,14,17-18H2,1-3H3,(H,31,33)(H,34,35)