[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] 2-[(2-methoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] 2-[(2-methoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethyl] 2-[(2-methoxybenzoyl)amino]acetate CAS Name: 2-[[(2-methoxyphenyl)-oxomethyl]amino]acetic acid [2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] 2-[(2-methoxybenzoyl)amino]acetate Traditional Name: 2-(o-anisoylamino)acetic acid [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethyl] ester Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)COC(=O)CNC(=O)C2=CC=CC=C2OC

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)COC(=O)CNC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C18H21N3O5/c1-18(11-19,12-7-8-12)21-15(22)10-26-16(23)9-20-17(24)13-5-3-4-6-14(13)25-2/h3-6,12H,7-10H2,1-2H3,(H,20,24)(H,21,22)/t18-/m0/s1