(E)-1-[4-(4-pyrrolidin-1-ylpiperidin-1-yl)carbonylphenyl]-3-quinolin-2-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-pyrrolidin-1-ylpiperidin-1-yl)carbonylphenyl]-3-quinolin-2-yl-prop-2-en-1-one Openeye Name: (E)-1-[4-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)phenyl]-3-(2-quinolyl)prop-2-en-1-one CAS Name: (E)-1-[4-[oxo-[4-(1-pyrrolidinyl)-1-piperidinyl]methyl]phenyl]-3-(2-quinolinyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)phenyl]-3-quinolin-2-ylprop-2-en-1-one Traditional Name: (E)-1-[4-(4-pyrrolidinopiperidine-1-carbonyl)phenyl]-3-(2-quinolyl)prop-2-en-1-one Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C(=O)C=CC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(C1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C(=O)/C=C/C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H29N3O2/c32-27(14-13-24-12-11-21-5-1-2-6-26(21)29-24)22-7-9-23(10-8-22)28(33)31-19-15-25(16-20-31)30-17-3-4-18-30/h1-2,5-14,25H,3-4,15-20H2/b14-13+