ethyl 4-[(E)-indol-3-ylidenemethyl]-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-[(E)-indol-3-ylidenemethyl]-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-[(E)-indol-3-ylidenemethyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylate CAS Name: 4-[(E)-3-indolylidenemethyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-indol-3-ylidenemethyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 4-[(E)-indol-3-ylidenemethyl]-5-keto-1-phenyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C=NC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(N1)C2=CC=CC=C2)/C=C\3/C=NC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O3/c1-2-27-21(26)19-17(12-14-13-22-18-11-7-6-10-16(14)18)20(25)24(23-19)15-8-4-3-5-9-15/h3-13,23H,2H2,1H3/b14-12-