[(3S)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 2-[(2-ethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [(3S)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 2-[(2-ethoxyphenyl)carbonylamino]ethanoate Openeye Name: [(3S)-3-cyano-4-imino-2-oxo-pentyl] 2-[(2-ethoxybenzoyl)amino]acetate CAS Name: 2-[[(2-ethoxyphenyl)-oxomethyl]amino]acetic acid [(3S)-3-cyano-4-imino-2-oxopentyl] ester IUPAC Name: [(3S)-3-cyano-4-imino-2-oxopentyl] 2-[(2-ethoxybenzoyl)amino]acetate Traditional Name: 2-[(2-ethoxybenzoyl)amino]acetic acid [(3S)-3-cyano-4-imino-2-keto-pentyl] ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O5/c1-3-24-15-7-5-4-6-12(15)17(23)20-9-16(22)25-10-14(21)13(8-18)11(2)19/h4-7,13,19H,3,9-10H2,1-2H3,(H,20,23)/t13-/m1/s1