ethyl 2-azanyl-4-[5-(3-nitrophenyl)furan-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[5-(3-nitrophenyl)furan-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: ethyl 2-amino-4-[5-(3-nitrophenyl)-2-furyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-4-[5-(3-nitrophenyl)-2-furanyl]-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[5-(3-nitrophenyl)furan-2-yl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-5-keto-4-[5-(3-nitrophenyl)-2-furyl]-4,6,7,8-tetrahydrochromene-3-carboxylic acid ethyl ester Formula: C22H20N2O7 MolecularWeight: 424.4034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)CCC2)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)CCC2)N

InChI

InChI=1S/C22H20N2O7/c1-2-29-22(26)20-19(18-14(25)7-4-8-16(18)31-21(20)23)17-10-9-15(30-17)12-5-3-6-13(11-12)24(27)28/h3,5-6,9-11,19H,2,4,7-8,23H2,1H3