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

Systemtic Name: (3-methyl-1,2-oxazol-5-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3-methylisoxazol-5-yl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-methyl-5-isoxazolyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3-methyl-1,2-oxazol-5-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: [4-(4-methylbenzyl)-1,4-diazepan-1-yl]-(3-methylisoxazol-5-yl)methanone Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NO3)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NO3)C

InChI

InChI=1S/C18H23N3O2/c1-14-4-6-16(7-5-14)13-20-8-3-9-21(11-10-20)18(22)17-12-15(2)19-23-17/h4-7,12H,3,8-11,13H2,1-2H3