1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]-3-naphthalen-1-yl-prop-2-yn-1-one

Systemtic Name: 1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]-3-naphthalen-1-yl-prop-2-yn-1-one Openeye Name: 1-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]-3-(1-naphthyl)prop-2-yn-1-one CAS Name: 1-[4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]-3-(1-naphthalenyl)-2-propyn-1-one IUPAC Name: 1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]-3-naphthalen-1-ylprop-2-yn-1-one Traditional Name: 1-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]-3-(1-naphthyl)prop-2-yn-1-one Formula: C25H25N3O MolecularWeight: 383.4855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C#CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C#CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H25N3O/c1-20-7-4-11-23(26-20)19-27-15-6-16-28(18-17-27)25(29)14-13-22-10-5-9-21-8-2-3-12-24(21)22/h2-5,7-12H,6,15-19H2,1H3