(E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)-1-[4-(4-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C23H28ClN3O3 MolecularWeight: 429.93972

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=CC(=O)N2CCN(CC2)CC3=CC=NC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=C/C(=O)N2CCN(CC2)CC3=CC=NC=C3)OC

InChI

InChI=1S/C23H28ClN3O3/c1-3-14-30-23-20(24)15-19(16-21(23)29-2)4-5-22(28)27-12-10-26(11-13-27)17-18-6-8-25-9-7-18/h4-9,15-16H,3,10-14,17H2,1-2H3/b5-4+