4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)-N-ethyl-piperazine-1-carboxamide

Systemtic Name: 4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)-N-ethyl-piperazine-1-carboxamide Openeye Name: 4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)-N-ethyl-piperazine-1-carboxamide CAS Name: 4-(2,8-dimethyl-6-benzo[b][1,4]benzoxazepinyl)-N-ethyl-1-piperazinecarboxamide IUPAC Name: 4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)-N-ethylpiperazine-1-carboxamide Traditional Name: 4-(2,8-dimethylbenzo[b][1,4]benzoxazepin-6-yl)-N-ethyl-piperazine-1-carboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C2=NC3=C(C=C(C=C3)C)OC4=C2C=C(C=C4)C

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C2=NC3=C(C=C(C=C3)C)OC4=C2C=C(C=C4)C

InChI

InChI=1S/C22H26N4O2/c1-4-23-22(27)26-11-9-25(10-12-26)21-17-13-15(2)6-8-19(17)28-20-14-16(3)5-7-18(20)24-21/h5-8,13-14H,4,9-12H2,1-3H3,(H,23,27)