[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)C1=CC=CC(=C1)C#N

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)C1=CC=CC(=C1)C#N

InChI

InChI=1S/C15H18N2O3/c1-11(2)6-7-17-14(18)10-20-15(19)13-5-3-4-12(8-13)9-16/h3-5,8,11H,6-7,10H2,1-2H3,(H,17,18)