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

Systemtic Name: methyl 4-[[5-(2-ethylbutylcarbamoyl)-1H-indol-3-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[5-(2-ethylbutylcarbamoyl)-1H-indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[5-[(2-ethylbutylamino)-oxomethyl]-1H-indol-3-yl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-ethylbutylcarbamoyl)-1H-indol-3-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[5-(2-ethylbutylcarbamoyl)-1H-indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O4/c1-5-16(6-2)14-27-24(28)18-9-10-22-21(12-18)20(15-26-22)11-17-7-8-19(25(29)31-4)13-23(17)30-3/h7-10,12-13,15-16,26H,5-6,11,14H2,1-4H3,(H,27,28)