methyl (2R)-3-(1H-indol-3-yl)-2-[4-(3-methylphenoxy)butanoylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(3-methylphenoxy)butanoylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(3-methylphenoxy)butanoylamino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[4-(3-methylphenoxy)-1-oxobutyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(3-methylphenoxy)butanoylamino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[4-(3-methylphenoxy)butanoylamino]propionic acid methyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C23H26N2O4/c1-16-7-5-8-18(13-16)29-12-6-11-22(26)25-21(23(27)28-2)14-17-15-24-20-10-4-3-9-19(17)20/h3-5,7-10,13,15,21,24H,6,11-12,14H2,1-2H3,(H,25,26)/t21-/m1/s1