2-[[2-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-3-phenyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-3-phenyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[(5-chloro-1H-indole-2-carbonyl)amino]-3-phenyl-propanoyl]amino]acetic acid CAS Name: 2-[[2-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]acetic acid IUPAC Name: 2-[[2-[(5-chloro-1H-indole-2-carbonyl)amino]-3-phenylpropanoyl]amino]acetic acid Traditional Name: 2-[[2-[(5-chloro-1H-indole-2-carbonyl)amino]-3-phenyl-propanoyl]amino]acetic acid Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC(=O)O)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCC(=O)O)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C20H18ClN3O4/c21-14-6-7-15-13(9-14)10-17(23-15)20(28)24-16(19(27)22-11-18(25)26)8-12-4-2-1-3-5-12/h1-7,9-10,16,23H,8,11H2,(H,22,27)(H,24,28)(H,25,26)