2-[[3-(2-indol-1-ylethoxy)phenyl]methyl-(phenylmethyl)amino]butanoic acid

Systemtic Name: 2-[[3-(2-indol-1-ylethoxy)phenyl]methyl-(phenylmethyl)amino]butanoic acid Openeye Name: 2-[benzyl-[[3-(2-indol-1-ylethoxy)phenyl]methyl]amino]butanoic acid CAS Name: 2-[[3-[2-(1-indolyl)ethoxy]phenyl]methyl-(phenylmethyl)amino]butanoic acid IUPAC Name: 2-[benzyl-[[3-(2-indol-1-ylethoxy)phenyl]methyl]amino]butanoic acid Traditional Name: 2-[benzyl-[3-(2-indol-1-ylethoxy)benzyl]amino]butyric acid Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N(CC1=CC=CC=C1)CC2=CC(=CC=C2)OCCN3C=CC4=CC=CC=C43

Isomeric SMILES

CCC(C(=O)O)N(CC1=CC=CC=C1)CC2=CC(=CC=C2)OCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C28H30N2O3/c1-2-26(28(31)32)30(20-22-9-4-3-5-10-22)21-23-11-8-13-25(19-23)33-18-17-29-16-15-24-12-6-7-14-27(24)29/h3-16,19,26H,2,17-18,20-21H2,1H3,(H,31,32)