[3-hexoxy-4-[(E)-2-quinolin-4-ylethenyl]phenyl] 2-methylprop-2-enoate

Systemtic Name: [3-hexoxy-4-[(E)-2-quinolin-4-ylethenyl]phenyl] 2-methylprop-2-enoate Openeye Name: [3-hexoxy-4-[(E)-2-(4-quinolyl)vinyl]phenyl] 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [3-hexoxy-4-[(E)-2-(4-quinolinyl)ethenyl]phenyl] ester IUPAC Name: [3-hexoxy-4-[(E)-2-quinolin-4-ylethenyl]phenyl] 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [3-hexoxy-4-[(E)-2-(4-quinolyl)vinyl]phenyl] ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC(=C1)OC(=O)C(=C)C)C=CC2=CC=NC3=CC=CC=C23

Isomeric SMILES

CCCCCCOC1=C(C=CC(=C1)OC(=O)C(=C)C)/C=C/C2=CC=NC3=CC=CC=C23

InChI

InChI=1S/C27H29NO3/c1-4-5-6-9-18-30-26-19-23(31-27(29)20(2)3)15-14-22(26)13-12-21-16-17-28-25-11-8-7-10-24(21)25/h7-8,10-17,19H,2,4-6,9,18H2,1,3H3/b13-12+