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

Systemtic Name: methyl 3-methoxy-4-[[1-methyl-5-(2-methylheptylcarbamoyl)indol-3-yl]methyl]benzoate Openeye Name: methyl 3-methoxy-4-[[1-methyl-5-(2-methylheptylcarbamoyl)indol-3-yl]methyl]benzoate CAS Name: 3-methoxy-4-[[1-methyl-5-[(2-methylheptylamino)-oxomethyl]-3-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-[[1-methyl-5-(2-methylheptylcarbamoyl)indol-3-yl]methyl]benzoate Traditional Name: 3-methoxy-4-[[1-methyl-5-(2-methylheptylcarbamoyl)indol-3-yl]methyl]benzoic acid methyl ester Formula: C28H36N2O4 MolecularWeight: 464.59644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O4/c1-6-7-8-9-19(2)17-29-27(31)21-12-13-25-24(15-21)23(18-30(25)3)14-20-10-11-22(28(32)34-5)16-26(20)33-4/h10-13,15-16,18-19H,6-9,14,17H2,1-5H3,(H,29,31)