[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 2,4-dimethoxybenzoate

Systemtic Name: [2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 2,4-dimethoxybenzoate Openeye Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxo-ethyl] 2,4-dimethoxybenzoate CAS Name: 2,4-dimethoxybenzoic acid [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] 2,4-dimethoxybenzoate Traditional Name: 2,4-dimethoxybenzoic acid [2-keto-2-[2-(4-nitroanilino)ethylamino]ethyl] ester Formula: C19H21N3O7 MolecularWeight: 403.38594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21N3O7/c1-27-15-7-8-16(17(11-15)28-2)19(24)29-12-18(23)21-10-9-20-13-3-5-14(6-4-13)22(25)26/h3-8,11,20H,9-10,12H2,1-2H3,(H,21,23)