4-(2,3,4,5,9,9a-hexahydro-1,5-benzoxazepin-9-ylcarbonyl)piperazine-1-carboxamide

Systemtic Name: 4-(2,3,4,5,9,9a-hexahydro-1,5-benzoxazepin-9-ylcarbonyl)piperazine-1-carboxamide Openeye Name: 4-(2,3,4,5,9,9a-hexahydro-1,5-benzoxazepine-9-carbonyl)piperazine-1-carboxamide CAS Name: 4-[2,3,4,5,9,9a-hexahydro-1,5-benzoxazepin-9-yl(oxo)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(2,3,4,5,9,9a-hexahydro-1,5-benzoxazepine-9-carbonyl)piperazine-1-carboxamide Traditional Name: 4-(2,3,4,5,9,9a-hexahydro-1,5-benzoxazepine-9-carbonyl)piperazine-1-carboxamide Formula: C15H22N4O3 MolecularWeight: 306.36018

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=CC=CC(C2OC1)C(=O)N3CCN(CC3)C(=O)N

Isomeric SMILES

C1CNC2=CC=CC(C2OC1)C(=O)N3CCN(CC3)C(=O)N

InChI

InChI=1S/C15H22N4O3/c16-15(21)19-8-6-18(7-9-19)14(20)11-3-1-4-12-13(11)22-10-2-5-17-12/h1,3-4,11,13,17H,2,5-10H2,(H2,16,21)