[2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] 2-[(2-ethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] 2-[(2-ethoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethyl] 2-[(2-ethoxybenzoyl)amino]acetate CAS Name: 2-[[(2-ethoxyphenyl)-oxomethyl]amino]acetic acid [2-[[(1S)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate Traditional Name: 2-[(2-ethoxybenzoyl)amino]acetic acid [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethyl] ester Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NCC(=O)OCC(=O)NC(C)(C#N)C2CC2

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NCC(=O)OCC(=O)N[C@](C)(C#N)C2CC2

InChI

InChI=1S/C19H23N3O5/c1-3-26-15-7-5-4-6-14(15)18(25)21-10-17(24)27-11-16(23)22-19(2,12-20)13-8-9-13/h4-7,13H,3,8-11H2,1-2H3,(H,21,25)(H,22,23)/t19-/m1/s1