(2R)-4-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-4-oxidanylidene-2-phenyl-butanoate

Systemtic Name: (2R)-4-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-4-oxidanylidene-2-phenyl-butanoate Openeye Name: (2R)-4-(4-chloro-2,5-dimethoxy-anilino)-4-oxo-2-phenyl-butanoate CAS Name: (2R)-4-(4-chloro-2,5-dimethoxyanilino)-4-oxo-2-phenylbutanoate IUPAC Name: (2R)-4-(4-chloro-2,5-dimethoxyanilino)-4-oxo-2-phenylbutanoate Traditional Name: (2R)-4-(4-chloro-2,5-dimethoxy-anilino)-4-keto-2-phenyl-butyrate Formula: C18H17ClNO5- MolecularWeight: 362.78428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CC(C2=CC=CC=C2)C(=O)[O-])OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C[C@H](C2=CC=CC=C2)C(=O)[O-])OC)Cl

InChI

InChI=1S/C18H18ClNO5/c1-24-15-10-14(16(25-2)9-13(15)19)20-17(21)8-12(18(22)23)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3,(H,20,21)(H,22,23)/p-1/t12-/m1/s1