methyl 2-azanyl-4-(1-cyano-2-methoxy-2-oxidanylidene-ethyl)-6-nitro-4H-chromene-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-(1-cyano-2-methoxy-2-oxidanylidene-ethyl)-6-nitro-4H-chromene-3-carboxylate Openeye Name: methyl 2-amino-4-(1-cyano-2-methoxy-2-oxo-ethyl)-6-nitro-4H-chromene-3-carboxylate CAS Name: 2-amino-4-(1-cyano-2-methoxy-2-oxoethyl)-6-nitro-4H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(1-cyano-2-methoxy-2-oxoethyl)-6-nitro-4H-chromene-3-carboxylate Traditional Name: 2-amino-4-(1-cyano-2-keto-2-methoxy-ethyl)-6-nitro-4H-chromene-3-carboxylic acid methyl ester Formula: C15H13N3O7 MolecularWeight: 347.27962

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C(C1C(C#N)C(=O)OC)C=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=C(OC2=C(C1C(C#N)C(=O)OC)C=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C15H13N3O7/c1-23-14(19)9(6-16)11-8-5-7(18(21)22)3-4-10(8)25-13(17)12(11)15(20)24-2/h3-5,9,11H,17H2,1-2H3