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

Systemtic Name: (5-methyl-2-oxidanyl-phenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (2-hydroxy-5-methyl-phenyl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2-hydroxy-5-methylphenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (2-hydroxy-5-methylphenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (2-hydroxy-5-methyl-phenyl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2/c1-16-4-7-18(8-5-16)15-22-10-3-11-23(13-12-22)21(25)19-14-17(2)6-9-20(19)24/h4-9,14,24H,3,10-13,15H2,1-2H3