methyl 4-[[5-(2-ethylbutylcarbamoyl)-1-(phenylmethyl)indol-3-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[5-(2-ethylbutylcarbamoyl)-1-(phenylmethyl)indol-3-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[1-benzyl-5-(2-ethylbutylcarbamoyl)indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[5-[(2-ethylbutylamino)-oxomethyl]-1-(phenylmethyl)-3-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[1-benzyl-5-(2-ethylbutylcarbamoyl)indol-3-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[1-benzyl-5-(2-ethylbutylcarbamoyl)indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C32H36N2O4 MolecularWeight: 512.63924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC(=O)C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)CC4=CC=CC=C4

Isomeric SMILES

CCC(CC)CNC(=O)C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)CC4=CC=CC=C4

InChI

InChI=1S/C32H36N2O4/c1-5-22(6-2)19-33-31(35)25-14-15-29-28(17-25)27(21-34(29)20-23-10-8-7-9-11-23)16-24-12-13-26(32(36)38-4)18-30(24)37-3/h7-15,17-18,21-22H,5-6,16,19-20H2,1-4H3,(H,33,35)