3-cyanopropyl 2-benzamido-3-phenyl-propanoate

Systemtic Name: 3-cyanopropyl 2-benzamido-3-phenyl-propanoate Openeye Name: 3-cyanopropyl 2-benzamido-3-phenyl-propanoate CAS Name: 2-benzamido-3-phenylpropanoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-benzamido-3-phenylpropanoate Traditional Name: 2-benzamido-3-phenyl-propionic acid 3-cyanopropyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O3/c21-13-7-8-14-25-20(24)18(15-16-9-3-1-4-10-16)22-19(23)17-11-5-2-6-12-17/h1-6,9-12,18H,7-8,14-15H2,(H,22,23)