4-(4-butoxy-3-chloranyl-5-methoxy-phenyl)carbonylpiperazin-2-one

Systemtic Name: 4-(4-butoxy-3-chloranyl-5-methoxy-phenyl)carbonylpiperazin-2-one Openeye Name: 4-(4-butoxy-3-chloro-5-methoxy-benzoyl)piperazin-2-one CAS Name: 4-[(4-butoxy-3-chloro-5-methoxyphenyl)-oxomethyl]-2-piperazinone IUPAC Name: 4-(4-butoxy-3-chloro-5-methoxybenzoyl)piperazin-2-one Traditional Name: 4-(4-butoxy-3-chloro-5-methoxy-benzoyl)piperazin-2-one Formula: C16H21ClN2O4 MolecularWeight: 340.80194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)N2CCNC(=O)C2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)N2CCNC(=O)C2)OC

InChI

InChI=1S/C16H21ClN2O4/c1-3-4-7-23-15-12(17)8-11(9-13(15)22-2)16(21)19-6-5-18-14(20)10-19/h8-9H,3-7,10H2,1-2H3,(H,18,20)