methyl 3-methoxy-4-[[5-(2-methylpropylcarbamoyl)-1-propyl-indol-3-yl]methyl]benzoate

Systemtic Name: methyl 3-methoxy-4-[[5-(2-methylpropylcarbamoyl)-1-propyl-indol-3-yl]methyl]benzoate Openeye Name: methyl 4-[[5-(isobutylcarbamoyl)-1-propyl-indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 3-methoxy-4-[[5-[(2-methylpropylamino)-oxomethyl]-1-propyl-3-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-[[5-(2-methylpropylcarbamoyl)-1-propylindol-3-yl]methyl]benzoate Traditional Name: 4-[[5-(isobutylcarbamoyl)-1-propyl-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:

CCCN1C=C(C2=C1C=CC(=C2)C(=O)NCC(C)C)CC3=C(C=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CCCN1C=C(C2=C1C=CC(=C2)C(=O)NCC(C)C)CC3=C(C=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C26H32N2O4/c1-6-11-28-16-21(12-18-7-8-20(26(30)32-5)14-24(18)31-4)22-13-19(9-10-23(22)28)25(29)27-15-17(2)3/h7-10,13-14,16-17H,6,11-12,15H2,1-5H3,(H,27,29)