[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-(4-prop-2-enyl-1,4-diazepan-1-yl)methanone

Systemtic Name: [3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-(4-prop-2-enyl-1,4-diazepan-1-yl)methanone Openeye Name: (4-allyl-1,4-diazepan-1-yl)-[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]methanone CAS Name: [3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-(4-prop-2-enyl-1,4-diazepan-1-yl)methanone IUPAC Name: [3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-(4-prop-2-enyl-1,4-diazepan-1-yl)methanone Traditional Name: (4-allyl-1,4-diazepan-1-yl)-[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]methanone Formula: C19H22ClN3O2 MolecularWeight: 359.84988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N3CCCN(CC3)CC=C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N3CCCN(CC3)CC=C

InChI

InChI=1S/C19H22ClN3O2/c1-3-9-22-10-6-11-23(13-12-22)19(24)17-14(2)25-21-18(17)15-7-4-5-8-16(15)20/h3-5,7-8H,1,6,9-13H2,2H3