4-[4-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]butyl]-7-methoxy-3-methyl-1,4-benzoxazepin-5-one

Systemtic Name: 4-[4-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]butyl]-7-methoxy-3-methyl-1,4-benzoxazepin-5-one Openeye Name: 4-[4-[4-(6-chloro-2-pyridyl)piperazin-1-yl]butyl]-7-methoxy-3-methyl-1,4-benzoxazepin-5-one CAS Name: 4-[4-[4-(6-chloro-2-pyridinyl)-1-piperazinyl]butyl]-7-methoxy-3-methyl-1,4-benzoxazepin-5-one IUPAC Name: 4-[4-[4-(6-chloropyridin-2-yl)piperazin-1-yl]butyl]-7-methoxy-3-methyl-1,4-benzoxazepin-5-one Traditional Name: 4-[4-[4-(6-chloro-2-pyridyl)piperazino]butyl]-7-methoxy-3-methyl-1,4-benzoxazepin-5-one Formula: C24H29ClN4O3 MolecularWeight: 456.96506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C(C=C(C=C2)OC)C(=O)N1CCCCN3CCN(CC3)C4=NC(=CC=C4)Cl

Isomeric SMILES

CC1=COC2=C(C=C(C=C2)OC)C(=O)N1CCCCN3CCN(CC3)C4=NC(=CC=C4)Cl

InChI

InChI=1S/C24H29ClN4O3/c1-18-17-32-21-9-8-19(31-2)16-20(21)24(30)29(18)11-4-3-10-27-12-14-28(15-13-27)23-7-5-6-22(25)26-23/h5-9,16-17H,3-4,10-15H2,1-2H3