[2-[2-[ethyl-(3-methylphenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 4-pyrazol-1-ylbenzoate

Systemtic Name: [2-[2-[ethyl-(3-methylphenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 4-pyrazol-1-ylbenzoate Openeye Name: [2-[2-(N-ethyl-3-methyl-anilino)ethylamino]-2-oxo-ethyl] 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid [2-[2-(N-ethyl-3-methylanilino)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(N-ethyl-3-methylanilino)ethylamino]-2-oxoethyl] 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid [2-[2-(N-ethyl-3-methyl-anilino)ethylamino]-2-keto-ethyl] ester Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)COC(=O)C1=CC=C(C=C1)N2C=CC=N2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=O)COC(=O)C1=CC=C(C=C1)N2C=CC=N2)C3=CC=CC(=C3)C

InChI

InChI=1S/C23H26N4O3/c1-3-26(21-7-4-6-18(2)16-21)15-13-24-22(28)17-30-23(29)19-8-10-20(11-9-19)27-14-5-12-25-27/h4-12,14,16H,3,13,15,17H2,1-2H3,(H,24,28)