[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 4-methylbenzoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 4-methylbenzoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C16H22N2O4/c1-11(2)8-9-17-16(21)18-14(19)10-22-15(20)13-6-4-12(3)5-7-13/h4-7,11H,8-10H2,1-3H3,(H2,17,18,19,21)