ethyl 3-(1-methylindol-3-yl)-5-phenyl-3,4-dihydropyrazole-2-carboxylate

Systemtic Name: ethyl 3-(1-methylindol-3-yl)-5-phenyl-3,4-dihydropyrazole-2-carboxylate Openeye Name: ethyl 3-(1-methylindol-3-yl)-5-phenyl-3,4-dihydropyrazole-2-carboxylate CAS Name: 3-(1-methyl-3-indolyl)-5-phenyl-3,4-dihydropyrazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1-methylindol-3-yl)-5-phenyl-3,4-dihydropyrazole-2-carboxylate Traditional Name: 5-(1-methylindol-3-yl)-3-phenyl-2-pyrazoline-1-carboxylic acid ethyl ester Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C21H21N3O2/c1-3-26-21(25)24-20(13-18(22-24)15-9-5-4-6-10-15)17-14-23(2)19-12-8-7-11-16(17)19/h4-12,14,20H,3,13H2,1-2H3