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

Systemtic Name: 4-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,4-benzoxazin-3-one Openeye Name: 4-[4-(4-benzhydrylpiperazin-1-yl)-4-oxo-butyl]-1,4-benzoxazin-3-one CAS Name: 4-[4-[4-(diphenylmethyl)-1-piperazinyl]-4-oxobutyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[4-(4-benzhydrylpiperazin-1-yl)-4-oxobutyl]-1,4-benzoxazin-3-one Traditional Name: 4-[4-(4-benzhydrylpiperazino)-4-keto-butyl]-1,4-benzoxazin-3-one Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCN4C(=O)COC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCN4C(=O)COC5=CC=CC=C54

InChI

InChI=1S/C29H31N3O3/c33-27(16-9-17-32-25-14-7-8-15-26(25)35-22-28(32)34)30-18-20-31(21-19-30)29(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-8,10-15,29H,9,16-22H2