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

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[(3-methoxyphenyl)carbonylamino]ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-[(3-methoxybenzoyl)amino]acetate CAS Name: 2-[[(3-methoxyphenyl)-oxomethyl]amino]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-[(3-methoxybenzoyl)amino]acetate Traditional Name: 2-(m-anisoylamino)acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CNC(=O)C1=CC(=CC=C1)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CNC(=O)C1=CC(=CC=C1)OC

InChI

InChI=1S/C16H17N3O5/c1-10(18)13(7-17)14(20)9-24-15(21)8-19-16(22)11-4-3-5-12(6-11)23-2/h3-6,13,18H,8-9H2,1-2H3,(H,19,22)