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

Systemtic Name: methyl 4-[[5-(2-ethylbutylcarbamoyl)-1-propan-2-yl-indol-3-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[5-(2-ethylbutylcarbamoyl)-1-isopropyl-indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[5-[(2-ethylbutylamino)-oxomethyl]-1-propan-2-yl-3-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-ethylbutylcarbamoyl)-1-propan-2-ylindol-3-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[5-(2-ethylbutylcarbamoyl)-1-isopropyl-indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C28H36N2O4 MolecularWeight: 464.59644

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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)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O4/c1-7-19(8-2)16-29-27(31)21-11-12-25-24(14-21)23(17-30(25)18(3)4)13-20-9-10-22(28(32)34-6)15-26(20)33-5/h9-12,14-15,17-19H,7-8,13,16H2,1-6H3,(H,29,31)