methyl 4-[2-(ethylcarbamoylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-(ethylcarbamoylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(ethylcarbamoylamino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(ethylcarbamoylamino)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(ethylcarbamoylamino)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-(ethylcarbamoylamino)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C13H15N3O7 MolecularWeight: 325.2741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)NC(=O)COC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O7/c1-3-14-13(19)15-11(17)7-23-10-5-4-8(12(18)22-2)6-9(10)16(20)21/h4-6H,3,7H2,1-2H3,(H2,14,15,17,19)