[4-(4-butoxy-3-chloranyl-5-ethoxy-phenyl)carbonylpiperazin-1-yl]-(3-methoxyphenyl)methanone

Systemtic Name: [4-(4-butoxy-3-chloranyl-5-ethoxy-phenyl)carbonylpiperazin-1-yl]-(3-methoxyphenyl)methanone Openeye Name: [4-(4-butoxy-3-chloro-5-ethoxy-benzoyl)piperazin-1-yl]-(3-methoxyphenyl)methanone CAS Name: [4-[(4-butoxy-3-chloro-5-ethoxyphenyl)-oxomethyl]-1-piperazinyl]-(3-methoxyphenyl)methanone IUPAC Name: [4-(4-butoxy-3-chloro-5-ethoxybenzoyl)piperazin-1-yl]-(3-methoxyphenyl)methanone Traditional Name: [4-(4-butoxy-3-chloro-5-ethoxy-benzoyl)piperazino]-(3-methoxyphenyl)methanone Formula: C25H31ClN2O5 MolecularWeight: 474.97704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)OC)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)OC)OCC

InChI

InChI=1S/C25H31ClN2O5/c1-4-6-14-33-23-21(26)16-19(17-22(23)32-5-2)25(30)28-12-10-27(11-13-28)24(29)18-8-7-9-20(15-18)31-3/h7-9,15-17H,4-6,10-14H2,1-3H3