4-[(2S)-2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[(2S)-2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[(2S)-2-[4-(azepane-1-carbonyl)-1-piperidyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[(2S)-2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[(2S)-2-[4-(azepane-1-carbonyl)piperidin-1-yl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[(2S)-2-[4-(azepane-1-carbonyl)piperidino]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C25H36N4O3 MolecularWeight: 440.57834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

C[C@@H](C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H36N4O3/c1-18(22(30)29-21-11-7-6-10-20(21)26-24(32)25(29,2)3)27-16-12-19(13-17-27)23(31)28-14-8-4-5-9-15-28/h6-7,10-11,18-19H,4-5,8-9,12-17H2,1-3H3,(H,26,32)/t18-/m0/s1