(4-oxidanylidene-4-phenyl-butyl) 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: (4-oxidanylidene-4-phenyl-butyl) 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: (4-oxo-4-phenyl-butyl) 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid (4-oxo-4-phenylbutyl) ester IUPAC Name: (4-oxo-4-phenylbutyl) 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid (4-keto-4-phenyl-butyl) ester Formula: C18H18ClNO4 MolecularWeight: 347.79282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCCC(=O)C2=CC=CC=C2)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCCC(=O)C2=CC=CC=C2)Cl)N

InChI

InChI=1S/C18H18ClNO4/c1-23-17-11-15(20)14(19)10-13(17)18(22)24-9-5-8-16(21)12-6-3-2-4-7-12/h2-4,6-7,10-11H,5,8-9,20H2,1H3