ethyl 5-methyl-7-[(4-nitrophenyl)methoxy]-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate

Systemtic Name: ethyl 5-methyl-7-[(4-nitrophenyl)methoxy]-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate Openeye Name: ethyl 5-methyl-7-[(4-nitrophenyl)methoxy]-4-oxo-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate CAS Name: 5-methyl-7-[(4-nitrophenyl)methoxy]-4-oxo-3-(1-phenyl-4-pyrazolyl)-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-7-[(4-nitrophenyl)methoxy]-4-oxo-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate Traditional Name: 4-keto-5-methyl-7-(4-nitrobenzyl)oxy-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylic acid ethyl ester Formula: C29H23N3O7 MolecularWeight: 525.50882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2C)OCC3=CC=C(C=C3)[N+](=O)[O-])C4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2C)OCC3=CC=C(C=C3)[N+](=O)[O-])C4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H23N3O7/c1-3-37-29(34)28-26(20-15-30-31(16-20)21-7-5-4-6-8-21)27(33)25-18(2)13-23(14-24(25)39-28)38-17-19-9-11-22(12-10-19)32(35)36/h4-16H,3,17H2,1-2H3