3-[1-[5-(3,5-dimethyl-4-oxidanyl-phenyl)carbonylpyridin-2-yl]piperidin-4-yl]-4,5-dihydro-1H-1,3-benzodiazepin-2-one

Systemtic Name: 3-[1-[5-(3,5-dimethyl-4-oxidanyl-phenyl)carbonylpyridin-2-yl]piperidin-4-yl]-4,5-dihydro-1H-1,3-benzodiazepin-2-one Openeye Name: 3-[1-[5-(4-hydroxy-3,5-dimethyl-benzoyl)-2-pyridyl]-4-piperidyl]-4,5-dihydro-1H-1,3-benzodiazepin-2-one CAS Name: 3-[1-[5-[(4-hydroxy-3,5-dimethylphenyl)-oxomethyl]-2-pyridinyl]-4-piperidinyl]-4,5-dihydro-1H-1,3-benzodiazepin-2-one IUPAC Name: 3-[1-[5-(4-hydroxy-3,5-dimethylbenzoyl)pyridin-2-yl]piperidin-4-yl]-4,5-dihydro-1H-1,3-benzodiazepin-2-one Traditional Name: 3-[1-[5-(4-hydroxy-3,5-dimethyl-benzoyl)-2-pyridyl]-4-piperidyl]-4,5-dihydro-1H-1,3-benzodiazepin-2-one Formula: C28H30N4O3 MolecularWeight: 470.5628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(=O)C2=CN=C(C=C2)N3CCC(CC3)N4CCC5=CC=CC=C5NC4=O

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(=O)C2=CN=C(C=C2)N3CCC(CC3)N4CCC5=CC=CC=C5NC4=O

InChI

InChI=1S/C28H30N4O3/c1-18-15-22(16-19(2)26(18)33)27(34)21-7-8-25(29-17-21)31-12-10-23(11-13-31)32-14-9-20-5-3-4-6-24(20)30-28(32)35/h3-8,15-17,23,33H,9-14H2,1-2H3,(H,30,35)