4-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-7-methyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-7-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[4-(4-benzhydrylpiperazin-1-yl)-4-oxo-butyl]-7-methyl-1,4-benzoxazin-3-one CAS Name: 4-[4-[4-(diphenylmethyl)-1-piperazinyl]-4-oxobutyl]-7-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[4-(4-benzhydrylpiperazin-1-yl)-4-oxobutyl]-7-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[4-(4-benzhydrylpiperazino)-4-keto-butyl]-7-methyl-1,4-benzoxazin-3-one Formula: C30H33N3O3 MolecularWeight: 483.60132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)CO2)CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CO2)CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H33N3O3/c1-23-14-15-26-27(21-23)36-22-29(35)33(26)16-8-13-28(34)31-17-19-32(20-18-31)30(24-9-4-2-5-10-24)25-11-6-3-7-12-25/h2-7,9-12,14-15,21,30H,8,13,16-20,22H2,1H3