3-methylidene-2-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]isoindol-1-one

Systemtic Name: 3-methylidene-2-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]isoindol-1-one Openeye Name: 2-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxo-ethyl]-3-methylene-isoindolin-1-one CAS Name: 3-methylene-2-[2-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]-1-isoindolone IUPAC Name: 2-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxoethyl]-3-methylideneisoindol-1-one Traditional Name: 2-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-ethyl]-3-methylene-isoindolin-1-one Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2/c1-18-20-10-5-6-11-21(20)23(28)26(18)17-22(27)25-13-7-12-24(14-15-25)16-19-8-3-2-4-9-19/h2-6,8-11H,1,7,12-17H2