3-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-7-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one

Systemtic Name: 3-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-7-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one Openeye Name: 3-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]-7-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one CAS Name: 3-[2-[4-(2,5-dimethylphenyl)-1-piperazinyl]-2-oxoethyl]-7-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one IUPAC Name: 3-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-7-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one Traditional Name: 3-[2-[4-(2,5-dimethylphenyl)piperazino]-2-keto-ethyl]-7-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(C(=O)N2)CC(=O)N3CCN(CC3)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(C(=O)N2)CC(=O)N3CCN(CC3)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C24H29N3O3/c1-16-5-7-22-20(12-16)25-24(29)19(15-30-22)14-23(28)27-10-8-26(9-11-27)21-13-17(2)4-6-18(21)3/h4-7,12-13,19H,8-11,14-15H2,1-3H3,(H,25,29)