(E)-3-(1-methyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)-1-(4-oxidanyl-4-phenyl-piperidin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-methyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)-1-(4-oxidanyl-4-phenyl-piperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-hydroxy-4-phenyl-1-piperidyl)-3-(1-methyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)prop-2-en-1-one CAS Name: (E)-1-(4-hydroxy-4-phenyl-1-piperidinyl)-3-(1-methyl-2-phenyl-3-pyrrolo[2,3-b]pyridinyl)-2-propen-1-one IUPAC Name: (E)-1-(4-hydroxy-4-phenylpiperidin-1-yl)-3-(1-methyl-2-phenylpyrrolo[2,3-b]pyridin-3-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-hydroxy-4-phenyl-piperidino)-3-(1-methyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)prop-2-en-1-one Formula: C28H27N3O2 MolecularWeight: 437.53288

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C1N=CC=C2)C=CC(=O)N3CCC(CC3)(C4=CC=CC=C4)O)C5=CC=CC=C5

Isomeric SMILES

CN1C(=C(C2=C1N=CC=C2)/C=C/C(=O)N3CCC(CC3)(C4=CC=CC=C4)O)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O2/c1-30-26(21-9-4-2-5-10-21)23(24-13-8-18-29-27(24)30)14-15-25(32)31-19-16-28(33,17-20-31)22-11-6-3-7-12-22/h2-15,18,33H,16-17,19-20H2,1H3/b15-14+