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

Systemtic Name: (3-chloranyl-5-methoxy-4-propoxy-phenyl)-[4-(2-hydroxyphenyl)piperazin-1-yl]methanone Openeye Name: (3-chloro-5-methoxy-4-propoxy-phenyl)-[4-(2-hydroxyphenyl)piperazin-1-yl]methanone CAS Name: (3-chloro-5-methoxy-4-propoxyphenyl)-[4-(2-hydroxyphenyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-5-methoxy-4-propoxyphenyl)-[4-(2-hydroxyphenyl)piperazin-1-yl]methanone Traditional Name: (3-chloro-5-methoxy-4-propoxy-phenyl)-[4-(2-hydroxyphenyl)piperazino]methanone Formula: C21H25ClN2O4 MolecularWeight: 404.8872

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=CC=CC=C3O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=CC=CC=C3O)OC

InChI

InChI=1S/C21H25ClN2O4/c1-3-12-28-20-16(22)13-15(14-19(20)27-2)21(26)24-10-8-23(9-11-24)17-6-4-5-7-18(17)25/h4-7,13-14,25H,3,8-12H2,1-2H3