4-azanyl-2-[6-chloranyl-2-(phenylcarbonyl)-1H-indol-3-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[6-chloranyl-2-(phenylcarbonyl)-1H-indol-3-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-oxo-butanoic acid CAS Name: 4-amino-2-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-oxobutanoic acid IUPAC Name: 4-amino-2-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-oxobutanoic acid Traditional Name: 4-amino-2-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-keto-butyric acid Formula: C19H15ClN2O4 MolecularWeight: 370.7864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C3=C(N2)C=C(C=C3)Cl)C(CC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C3=C(N2)C=C(C=C3)Cl)C(CC(=O)N)C(=O)O

InChI

InChI=1S/C19H15ClN2O4/c20-11-6-7-12-14(8-11)22-17(18(24)10-4-2-1-3-5-10)16(12)13(19(25)26)9-15(21)23/h1-8,13,22H,9H2,(H2,21,23)(H,25,26)