3-[[4-(pyridin-4-ylmethyl)phenyl]amino]cyclohex-2-en-1-one

Systemtic Name: 3-[[4-(pyridin-4-ylmethyl)phenyl]amino]cyclohex-2-en-1-one Openeye Name: 3-[4-(4-pyridylmethyl)anilino]cyclohex-2-en-1-one CAS Name: 3-[4-(pyridin-4-ylmethyl)anilino]-1-cyclohex-2-enone IUPAC Name: 3-[4-(pyridin-4-ylmethyl)anilino]cyclohex-2-en-1-one Traditional Name: 3-[4-(4-pyridylmethyl)anilino]cyclohex-2-en-1-one Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

C1CC(=CC(=O)C1)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C18H18N2O/c21-18-3-1-2-17(13-18)20-16-6-4-14(5-7-16)12-15-8-10-19-11-9-15/h4-11,13,20H,1-3,12H2