methyl 5-azanyl-1-[4-(2,3-dihydroindol-1-ylcarbonyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[4-(2,3-dihydroindol-1-ylcarbonyl)phenyl]pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-[4-(indoline-1-carbonyl)phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[2,3-dihydroindol-1-yl(oxo)methyl]phenyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[4-(2,3-dihydroindole-1-carbonyl)phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-(indoline-1-carbonyl)phenyl]pyrazole-4-carboxylic acid methyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCC4=CC=CC=C43)N

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCC4=CC=CC=C43)N

InChI

InChI=1S/C20H18N4O3/c1-27-20(26)16-12-22-24(18(16)21)15-8-6-14(7-9-15)19(25)23-11-10-13-4-2-3-5-17(13)23/h2-9,12H,10-11,21H2,1H3