3-naphthalen-1-yl-1-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]prop-2-yn-1-one

Systemtic Name: 3-naphthalen-1-yl-1-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]prop-2-yn-1-one Openeye Name: 3-(1-naphthyl)-1-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]prop-2-yn-1-one CAS Name: 3-(1-naphthalenyl)-1-[4-(2-pyridinylmethyl)-1,4-diazepan-1-yl]-2-propyn-1-one IUPAC Name: 3-naphthalen-1-yl-1-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]prop-2-yn-1-one Traditional Name: 3-(1-naphthyl)-1-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]prop-2-yn-1-one Formula: C24H23N3O MolecularWeight: 369.45892

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C#CC2=CC=CC3=CC=CC=C32)CC4=CC=CC=N4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C#CC2=CC=CC3=CC=CC=C32)CC4=CC=CC=N4

InChI

InChI=1S/C24H23N3O/c28-24(13-12-21-9-5-8-20-7-1-2-11-23(20)21)27-16-6-15-26(17-18-27)19-22-10-3-4-14-25-22/h1-5,7-11,14H,6,15-19H2