3-(1H-indol-3-yl)-2-[[4-(3-methylbutoxy)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[[4-(3-methylbutoxy)phenyl]carbonylamino]propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-[(4-isopentyloxybenzoyl)amino]propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-[[4-(3-methylbutoxy)benzoyl]amino]propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-[(4-isoamoxybenzoyl)amino]propionic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

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