1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]-3-naphthalen-1-yl-prop-2-yn-1-one

Systemtic Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]-3-naphthalen-1-yl-prop-2-yn-1-one Openeye Name: 1-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]-3-(1-naphthyl)prop-2-yn-1-one CAS Name: 1-[4-[(5-methyl-3-isoxazolyl)methyl]-1,4-diazepan-1-yl]-3-(1-naphthalenyl)-2-propyn-1-one IUPAC Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]-3-naphthalen-1-ylprop-2-yn-1-one Traditional Name: 1-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]-3-(1-naphthyl)prop-2-yn-1-one Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCCN(CC2)C(=O)C#CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=NO1)CN2CCCN(CC2)C(=O)C#CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H23N3O2/c1-18-16-21(24-28-18)17-25-12-5-13-26(15-14-25)23(27)11-10-20-8-4-7-19-6-2-3-9-22(19)20/h2-4,6-9,16H,5,12-15,17H2,1H3