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

Systemtic Name: [4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenyl-1,2-oxazol-5-yl)methanone Openeye Name: (3-phenylisoxazol-5-yl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: [4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenyl-5-isoxazolyl)methanone IUPAC Name: [4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenyl-1,2-oxazol-5-yl)methanone Traditional Name: [4-(4-methylbenzyl)-1,4-diazepan-1-yl]-(3-phenylisoxazol-5-yl)methanone Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2/c1-18-8-10-19(11-9-18)17-25-12-5-13-26(15-14-25)23(27)22-16-21(24-28-22)20-6-3-2-4-7-20/h2-4,6-11,16H,5,12-15,17H2,1H3