[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-nitrophenoxy)ethanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-nitrophenoxy)ethanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H21N3O7 MolecularWeight: 367.35384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O7/c1-11(2)7-8-17-16(22)18-14(20)9-26-15(21)10-25-13-6-4-3-5-12(13)19(23)24/h3-6,11H,7-10H2,1-2H3,(H2,17,18,20,22)