methyl 2-azanyl-7-methyl-4-(4-nitrophenyl)-5-oxidanylidene-6-phenethyl-pyrano[3,2-c]pyridin-6-ium-3-carboxylate

Systemtic Name: methyl 2-azanyl-7-methyl-4-(4-nitrophenyl)-5-oxidanylidene-6-phenethyl-pyrano[3,2-c]pyridin-6-ium-3-carboxylate Openeye Name: methyl 2-amino-7-methyl-4-(4-nitrophenyl)-5-oxo-6-phenethyl-pyrano[3,2-c]pyridin-6-ium-3-carboxylate CAS Name: 2-amino-7-methyl-4-(4-nitrophenyl)-5-oxo-6-phenethyl-3-pyrano[3,2-c]pyridin-6-iumcarboxylic acid methyl ester IUPAC Name: methyl 2-amino-7-methyl-4-(4-nitrophenyl)-5-oxo-6-phenethylpyrano[3,2-c]pyridin-6-ium-3-carboxylate Traditional Name: 2-amino-5-keto-7-methyl-4-(4-nitrophenyl)-6-phenethyl-pyrano[3,2-c]pyridin-6-ium-3-carboxylic acid methyl ester Formula: C25H22N3O6+ MolecularWeight: 460.45868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)C2=C(C(=C(OC2=C1)N)C(=O)OC)C3=CC=C(C=C3)[N+](=O)[O-])CCC4=CC=CC=C4

Isomeric SMILES

CC1=[N+](C(=O)C2=C(C(=C(OC2=C1)N)C(=O)OC)C3=CC=C(C=C3)[N+](=O)[O-])CCC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O6/c1-15-14-19-21(24(29)27(15)13-12-16-6-4-3-5-7-16)20(22(23(26)34-19)25(30)33-2)17-8-10-18(11-9-17)28(31)32/h3-11,14,26H,12-13H2,1-2H3/p+1