(4-cyanophenyl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: (4-cyanophenyl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: (4-cyanophenyl)methyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid (4-cyanobenzyl) ester Formula: C16H13ClN2O3 MolecularWeight: 316.73902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)C#N)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)C#N)Cl)N

InChI

InChI=1S/C16H13ClN2O3/c1-21-15-7-14(19)13(17)6-12(15)16(20)22-9-11-4-2-10(8-18)3-5-11/h2-7H,9,19H2,1H3