2-[2-(azepan-1-yl)-2-oxidanylidene-1-phenyl-ethyl]-3H-isoindol-1-one

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-1-phenyl-ethyl]-3H-isoindol-1-one Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-1-phenyl-ethyl]isoindolin-1-one CAS Name: 2-[2-(1-azepanyl)-2-oxo-1-phenylethyl]-3H-isoindol-1-one IUPAC Name: 2-[2-(azepan-1-yl)-2-oxo-1-phenylethyl]-3H-isoindol-1-one Traditional Name: 2-[2-(azepan-1-yl)-2-keto-1-phenyl-ethyl]isoindolin-1-one Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(C2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CCCN(CC1)C(=O)C(C2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H24N2O2/c25-21-19-13-7-6-12-18(19)16-24(21)20(17-10-4-3-5-11-17)22(26)23-14-8-1-2-9-15-23/h3-7,10-13,20H,1-2,8-9,14-16H2