methyl 3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzoate

Systemtic Name: methyl 3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzoate Openeye Name: methyl 3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzoate CAS Name: 3-methoxy-4-[[6-[(1-oxo-2-phenylbutyl)amino]-1-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzoate Traditional Name: 3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzoic acid methyl ester Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C=CN3CC4=C(C=C(C=C4)C(=O)OC)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C=CN3CC4=C(C=C(C=C4)C(=O)OC)OC

InChI

InChI=1S/C28H28N2O4/c1-4-24(19-8-6-5-7-9-19)27(31)29-23-13-12-20-14-15-30(25(20)17-23)18-22-11-10-21(28(32)34-3)16-26(22)33-2/h5-17,24H,4,18H2,1-3H3,(H,29,31)