methyl 4-[[5-(2,2-dimethylbutylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[5-(2,2-dimethylbutylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[5-(2,2-dimethylbutylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[5-[(2,2-dimethylbutylamino)-oxomethyl]-1-methyl-3-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2,2-dimethylbutylcarbamoyl)-1-methylindol-3-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[5-(2,2-dimethylbutylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CNC(=O)C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)C

Isomeric SMILES

CCC(C)(C)CNC(=O)C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)C

InChI

InChI=1S/C26H32N2O4/c1-7-26(2,3)16-27-24(29)18-10-11-22-21(13-18)20(15-28(22)4)12-17-8-9-19(25(30)32-6)14-23(17)31-5/h8-11,13-15H,7,12,16H2,1-6H3,(H,27,29)