3-phenoxypropyl 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: 3-phenoxypropyl 4-(2-cyanoethanoylamino)benzoate Openeye Name: 3-phenoxypropyl 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid 3-phenoxypropyl ester IUPAC Name: 3-phenoxypropyl 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid 3-phenoxypropyl ester Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCOC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)OCCCOC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C19H18N2O4/c20-12-11-18(22)21-16-9-7-15(8-10-16)19(23)25-14-4-13-24-17-5-2-1-3-6-17/h1-3,5-10H,4,11,13-14H2,(H,21,22)