[5-(1-benzamido-2-methoxy-2-oxidanylidene-ethyl)-2-(cyanomethyl)phenyl] benzoate

Systemtic Name: [5-(1-benzamido-2-methoxy-2-oxidanylidene-ethyl)-2-(cyanomethyl)phenyl] benzoate Openeye Name: [5-(1-benzamido-2-methoxy-2-oxo-ethyl)-2-(cyanomethyl)phenyl] benzoate CAS Name: benzoic acid [5-(1-benzamido-2-methoxy-2-oxoethyl)-2-(cyanomethyl)phenyl] ester IUPAC Name: [5-(1-benzamido-2-methoxy-2-oxoethyl)-2-(cyanomethyl)phenyl] benzoate Traditional Name: benzoic acid [5-(1-benzamido-2-keto-2-methoxy-ethyl)-2-(cyanomethyl)phenyl] ester Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC(=C(C=C1)CC#N)OC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(C1=CC(=C(C=C1)CC#N)OC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H20N2O5/c1-31-25(30)22(27-23(28)18-8-4-2-5-9-18)20-13-12-17(14-15-26)21(16-20)32-24(29)19-10-6-3-7-11-19/h2-13,16,22H,14H2,1H3,(H,27,28)