[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 3-(4-nitrophenyl)prop-2-enoate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 3-(4-nitrophenyl)prop-2-enoate CAS Name: 3-(4-nitrophenyl)-2-propenoic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 3-(4-nitrophenyl)prop-2-enoate Traditional Name: 3-(4-nitrophenyl)acrylic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C15H15N3O5 MolecularWeight: 317.2967

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O5/c1-17(10-2-9-16)14(19)11-23-15(20)8-5-12-3-6-13(7-4-12)18(21)22/h3-8H,2,10-11H2,1H3