2-[2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]propanoylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]propanoylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]propanoylamino]-2-phenyl-acetic acid CAS Name: 2-[[2-[[(5-methoxy-1-methyl-2-indolyl)-oxomethyl]amino]-1-oxopropyl]amino]-2-phenylacetic acid IUPAC Name: 2-[2-[(5-methoxy-1-methylindole-2-carbonyl)amino]propanoylamino]-2-phenylacetic acid Traditional Name: 2-[2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]propanoylamino]-2-phenyl-acetic acid Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C(=O)O)NC(=O)C2=CC3=C(N2C)C=CC(=C3)OC

Isomeric SMILES

CC(C(=O)NC(C1=CC=CC=C1)C(=O)O)NC(=O)C2=CC3=C(N2C)C=CC(=C3)OC

InChI

InChI=1S/C22H23N3O5/c1-13(20(26)24-19(22(28)29)14-7-5-4-6-8-14)23-21(27)18-12-15-11-16(30-3)9-10-17(15)25(18)2/h4-13,19H,1-3H3,(H,23,27)(H,24,26)(H,28,29)