[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O6/c1-2-8-16-15(21)17-13(19)10-24-14(20)7-6-11-4-3-5-12(9-11)18(22)23/h3-7,9H,2,8,10H2,1H3,(H2,16,17,19,21)/b7-6+