(E)-3-[4-(3-methylbutoxy)phenyl]-N-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)prop-2-enamide

Systemtic Name: (E)-3-[4-(3-methylbutoxy)phenyl]-N-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)prop-2-enamide Openeye Name: (E)-3-(4-isopentyloxyphenyl)-N-[4-methyl-2-(1-piperidyl)-6-quinolyl]prop-2-enamide CAS Name: (E)-3-[4-(3-methylbutoxy)phenyl]-N-[4-methyl-2-(1-piperidinyl)-6-quinolinyl]-2-propenamide IUPAC Name: (E)-3-[4-(3-methylbutoxy)phenyl]-N-(4-methyl-2-piperidin-1-ylquinolin-6-yl)prop-2-enamide Traditional Name: (E)-3-(4-isoamoxyphenyl)-N-(4-methyl-2-piperidino-6-quinolyl)acrylamide Formula: C29H35N3O2 MolecularWeight: 457.6071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)OCCC(C)C)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)OCCC(C)C)N4CCCCC4

InChI

InChI=1S/C29H35N3O2/c1-21(2)15-18-34-25-11-7-23(8-12-25)9-14-29(33)30-24-10-13-27-26(20-24)22(3)19-28(31-27)32-16-5-4-6-17-32/h7-14,19-21H,4-6,15-18H2,1-3H3,(H,30,33)/b14-9+