3-cyanopropyl 4-(acetamidomethyl)benzoate

Systemtic Name: 3-cyanopropyl 4-(acetamidomethyl)benzoate Openeye Name: 3-cyanopropyl 4-(acetamidomethyl)benzoate CAS Name: 4-(acetamidomethyl)benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 4-(acetamidomethyl)benzoate Traditional Name: 4-(acetamidomethyl)benzoic acid 3-cyanopropyl ester Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C(=O)OCCCC#N

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C(=O)OCCCC#N

InChI

InChI=1S/C14H16N2O3/c1-11(17)16-10-12-4-6-13(7-5-12)14(18)19-9-3-2-8-15/h4-7H,2-3,9-10H2,1H3,(H,16,17)