4-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C25H37N5O3 MolecularWeight: 455.59298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)N3CCN(CC3)CC(=O)N4CCCCCC4

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)N3CCN(CC3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C25H37N5O3/c1-19(23(32)30-21-11-7-6-10-20(21)26-24(33)25(30,2)3)28-16-14-27(15-17-28)18-22(31)29-12-8-4-5-9-13-29/h6-7,10-11,19H,4-5,8-9,12-18H2,1-3H3,(H,26,33)