4-[(5-chloranyl-2-phenylmethoxy-phenyl)methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(5-chloranyl-2-phenylmethoxy-phenyl)methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[(2-benzyloxy-5-chloro-phenyl)methylamino]-4-oxo-butanoate CAS Name: 4-[(5-chloro-2-phenylmethoxyphenyl)methylamino]-4-oxobutanoate IUPAC Name: 4-[(5-chloro-2-phenylmethoxyphenyl)methylamino]-4-oxobutanoate Traditional Name: 4-[(2-benzoxy-5-chloro-benzyl)amino]-4-keto-butyrate Formula: C18H17ClNO4- MolecularWeight: 346.78488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H18ClNO4/c19-15-6-7-16(24-12-13-4-2-1-3-5-13)14(10-15)11-20-17(21)8-9-18(22)23/h1-7,10H,8-9,11-12H2,(H,20,21)(H,22,23)/p-1