methyl 4-[2-[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-keto-2-[[2-keto-2-(propylamino)ethyl]-methyl-amino]ethoxy]-3-nitro-benzoic acid methyl ester Formula: C16H21N3O7 MolecularWeight: 367.35384

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)C(=O)COC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CN(C)C(=O)COC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O7/c1-4-7-17-14(20)9-18(2)15(21)10-26-13-6-5-11(16(22)25-3)8-12(13)19(23)24/h5-6,8H,4,7,9-10H2,1-3H3,(H,17,20)