methyl (E)-2-(2,2-dimethoxyethylcarbamoyl)-3-[(4-nitrophenyl)carbonylamino]prop-2-enoate

Systemtic Name: methyl (E)-2-(2,2-dimethoxyethylcarbamoyl)-3-[(4-nitrophenyl)carbonylamino]prop-2-enoate Openeye Name: methyl (E)-2-(2,2-dimethoxyethylcarbamoyl)-3-[(4-nitrobenzoyl)amino]prop-2-enoate CAS Name: (E)-2-[(2,2-dimethoxyethylamino)-oxomethyl]-3-[[(4-nitrophenyl)-oxomethyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-(2,2-dimethoxyethylcarbamoyl)-3-[(4-nitrobenzoyl)amino]prop-2-enoate Traditional Name: (E)-2-(2,2-dimethoxyethylcarbamoyl)-3-[(4-nitrobenzoyl)amino]acrylic acid methyl ester Formula: C16H19N3O8 MolecularWeight: 381.33736

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)C(=CNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

COC(CNC(=O)/C(=C\NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/C(=O)OC)OC

InChI

InChI=1S/C16H19N3O8/c1-25-13(26-2)9-18-15(21)12(16(22)27-3)8-17-14(20)10-4-6-11(7-5-10)19(23)24/h4-8,13H,9H2,1-3H3,(H,17,20)(H,18,21)/b12-8+