3-(methylamino)-7-phenyl-1-(pyridin-4-ylmethyl)azepan-2-one

Systemtic Name: 3-(methylamino)-7-phenyl-1-(pyridin-4-ylmethyl)azepan-2-one Openeye Name: 3-(methylamino)-7-phenyl-1-(4-pyridylmethyl)azepan-2-one CAS Name: 3-(methylamino)-7-phenyl-1-(pyridin-4-ylmethyl)-2-azepanone IUPAC Name: 3-(methylamino)-7-phenyl-1-(pyridin-4-ylmethyl)azepan-2-one Traditional Name: 3-(methylamino)-7-phenyl-1-(4-pyridylmethyl)azepan-2-one Formula: C19H23N3O MolecularWeight: 309.40542

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CCCC(N(C1=O)CC2=CC=NC=C2)C3=CC=CC=C3

Isomeric SMILES

CNC1CCCC(N(C1=O)CC2=CC=NC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N3O/c1-20-17-8-5-9-18(16-6-3-2-4-7-16)22(19(17)23)14-15-10-12-21-13-11-15/h2-4,6-7,10-13,17-18,20H,5,8-9,14H2,1H3