methyl 4-[[3-[[2-azanyl-6-(ethoxycarbonylamino)-3-nitro-pyridin-4-yl]amino]-2-oxidanylidene-propyl]-methyl-amino]benzoate

Systemtic Name: methyl 4-[[3-[[2-azanyl-6-(ethoxycarbonylamino)-3-nitro-pyridin-4-yl]amino]-2-oxidanylidene-propyl]-methyl-amino]benzoate Openeye Name: methyl 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitro-4-pyridyl]amino]-2-oxo-propyl]-methyl-amino]benzoate CAS Name: 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitro-4-pyridinyl]amino]-2-oxopropyl]-methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitropyridin-4-yl]amino]-2-oxopropyl]-methylamino]benzoate Traditional Name: 4-[[3-[[2-amino-6-(carbethoxyamino)-3-nitro-4-pyridyl]amino]-2-keto-propyl]-methyl-amino]benzoic acid methyl ester Formula: C20H24N6O7 MolecularWeight: 460.44056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC(=C(C(=C1)NCC(=O)CN(C)C2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)NC1=NC(=C(C(=C1)NCC(=O)CN(C)C2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-])N

InChI

InChI=1S/C20H24N6O7/c1-4-33-20(29)24-16-9-15(17(26(30)31)18(21)23-16)22-10-14(27)11-25(2)13-7-5-12(6-8-13)19(28)32-3/h5-9H,4,10-11H2,1-3H3,(H4,21,22,23,24,29)