8-chloranyl-4-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-2H-1-benzoxepin-5-one

Systemtic Name: 8-chloranyl-4-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-2H-1-benzoxepin-5-one Openeye Name: 8-chloro-4-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-2H-1-benzoxepin-5-one CAS Name: 8-chloro-4-[(4-methyl-1-piperazinyl)methyl]-3,4-dihydro-2H-1-benzoxepin-5-one IUPAC Name: 8-chloro-4-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-2H-1-benzoxepin-5-one Traditional Name: 8-chloro-4-[(4-methylpiperazino)methyl]-3,4-dihydro-2H-1-benzoxepin-5-one Formula: C16H21ClN2O2 MolecularWeight: 308.80314

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2CCOC3=C(C2=O)C=CC(=C3)Cl

Isomeric SMILES

CN1CCN(CC1)CC2CCOC3=C(C2=O)C=CC(=C3)Cl

InChI

InChI=1S/C16H21ClN2O2/c1-18-5-7-19(8-6-18)11-12-4-9-21-15-10-13(17)2-3-14(15)16(12)20/h2-3,10,12H,4-9,11H2,1H3