5-[2-(4-aminophenyl)ethyl]-4-[(E)-indol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[2-(4-aminophenyl)ethyl]-4-[(E)-indol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[2-(4-aminophenyl)ethyl]-4-[(E)-indol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[2-(4-aminophenyl)ethyl]-4-[(E)-2-indolylidenemethyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[2-(4-aminophenyl)ethyl]-4-[(E)-indol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[2-(4-aminophenyl)ethyl]-4-[(E)-indol-2-ylidenemethyl]-3-pyrazolin-3-one Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC3=C(NNC3=O)CCC4=CC=C(C=C4)N)N=C2C=C1

Isomeric SMILES

C1=CC2=C/C(=C\C3=C(NNC3=O)CCC4=CC=C(C=C4)N)/N=C2C=C1

InChI

InChI=1S/C20H18N4O/c21-15-8-5-13(6-9-15)7-10-19-17(20(25)24-23-19)12-16-11-14-3-1-2-4-18(14)22-16/h1-6,8-9,11-12H,7,10,21H2,(H2,23,24,25)/b16-12+