[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H23N3O7 MolecularWeight: 393.39112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C18H23N3O7/c1-11(2)5-6-19-18(25)21-15(22)9-26-16(23)8-20-17(24)12-3-4-13-14(7-12)28-10-27-13/h3-4,7,11H,5-6,8-10H2,1-2H3,(H,20,24)(H2,19,21,22,25)