4-[[3-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]methyl]-6-methyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[[3-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]methyl]-6-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[[3-(4-benzhydrylpiperazine-1-carbonyl)phenyl]methyl]-6-methyl-1,4-benzoxazin-3-one CAS Name: 4-[[3-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-6-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[[3-(4-benzhydrylpiperazine-1-carbonyl)phenyl]methyl]-6-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[3-(4-benzhydrylpiperazine-1-carbonyl)benzyl]-6-methyl-1,4-benzoxazin-3-one Formula: C34H33N3O3 MolecularWeight: 531.64412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H33N3O3/c1-25-15-16-31-30(21-25)37(32(38)24-40-31)23-26-9-8-14-29(22-26)34(39)36-19-17-35(18-20-36)33(27-10-4-2-5-11-27)28-12-6-3-7-13-28/h2-16,21-22,33H,17-20,23-24H2,1H3