ethyl 3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[methyl-[1-(3-nitrophenyl)ethyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H19N3O7 MolecularWeight: 401.37006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C)C(C)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C)C(C)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O7/c1-4-29-19(24)15-8-14(10-17(11-15)22(27)28)18(23)20(3)12(2)13-6-5-7-16(9-13)21(25)26/h5-12H,4H2,1-3H3