4-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-7-methyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-7-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]-7-methyl-1,4-benzoxazin-3-one CAS Name: 4-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]-7-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-7-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]-7-methyl-1,4-benzoxazin-3-one Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N3O3/c1-21-12-13-24-25(18-21)34-20-27(33)31(24)19-26(32)29-14-16-30(17-15-29)28(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-13,18,28H,14-17,19-20H2,1H3