3-chloranyl-4-[4-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one

Systemtic Name: 3-chloranyl-4-[4-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one Openeye Name: 3-chloro-4-[4-[4-(6-chloro-2-pyridyl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one CAS Name: 3-chloro-4-[4-[4-(6-chloro-2-pyridinyl)-1-piperazinyl]butyl]-8-methyl-1,4-benzoxazepin-5-one IUPAC Name: 3-chloro-4-[4-[4-(6-chloropyridin-2-yl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one Traditional Name: 3-chloro-4-[4-[4-(6-chloro-2-pyridyl)piperazino]butyl]-8-methyl-1,4-benzoxazepin-5-one Formula: C23H26Cl2N4O2 MolecularWeight: 461.38414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C(=CO2)Cl)CCCCN3CCN(CC3)C4=NC(=CC=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C(=CO2)Cl)CCCCN3CCN(CC3)C4=NC(=CC=C4)Cl

InChI

InChI=1S/C23H26Cl2N4O2/c1-17-7-8-18-19(15-17)31-16-21(25)29(23(18)30)10-3-2-9-27-11-13-28(14-12-27)22-6-4-5-20(24)26-22/h4-8,15-16H,2-3,9-14H2,1H3