methyl 1-[2-oxidanylidene-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-oxo-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-[2-[4-(1-pyrazolyl)phenyl]ethylamino]ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]indole-3-carboxylic acid methyl ester Formula: C23H22N4O3 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H22N4O3/c1-30-23(29)20-15-26(21-6-3-2-5-19(20)21)16-22(28)24-13-11-17-7-9-18(10-8-17)27-14-4-12-25-27/h2-10,12,14-15H,11,13,16H2,1H3,(H,24,28)