[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(3-methoxy-4-propoxy-phenyl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(3-methoxy-4-propoxy-phenyl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(3-methoxy-4-propoxy-phenyl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-(3-methoxy-4-propoxyphenyl)methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(3-methoxy-4-propoxyphenyl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-(3-methoxy-4-propoxy-phenyl)methanone Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)OC

InChI

InChI=1S/C22H27ClN2O3/c1-4-13-28-20-8-6-17(14-21(20)27-3)22(26)25-11-9-24(10-12-25)19-15-18(23)7-5-16(19)2/h5-8,14-15H,4,9-13H2,1-3H3