5-[4-(pentylamino)phenyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[4-(pentylamino)phenyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[4-(pentylamino)phenyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[4-(pentylamino)phenyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[4-(pentylamino)phenyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[4-(amylamino)phenyl]-3-pyrazolin-3-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=CC=C(C=C1)C2=CC(=O)NN2

Isomeric SMILES

CCCCCNC1=CC=C(C=C1)C2=CC(=O)NN2

InChI

InChI=1S/C14H19N3O/c1-2-3-4-9-15-12-7-5-11(6-8-12)13-10-14(18)17-16-13/h5-8,10,15H,2-4,9H2,1H3,(H2,16,17,18)