(E)-1-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[3-(1H-benzimidazol-2-yl)-1-piperidyl]-3-(3-chloro-5-methoxy-4-propoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-[3-(1H-benzimidazol-2-yl)-1-piperidinyl]-3-(3-chloro-5-methoxy-4-propoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-(3-chloro-5-methoxy-4-propoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[3-(1H-benzimidazol-2-yl)piperidino]-3-(3-chloro-5-methoxy-4-propoxy-phenyl)prop-2-en-1-one Formula: C25H28ClN3O3 MolecularWeight: 453.96112

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=CC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4N3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=C/C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4N3)OC

InChI

InChI=1S/C25H28ClN3O3/c1-3-13-32-24-19(26)14-17(15-22(24)31-2)10-11-23(30)29-12-6-7-18(16-29)25-27-20-8-4-5-9-21(20)28-25/h4-5,8-11,14-15,18H,3,6-7,12-13,16H2,1-2H3,(H,27,28)/b11-10+