[4-methoxy-1-octyl-2-oxidanylidene-7-[[(E)-3-phenylprop-2-enoyl]amino]quinolin-3-yl] ethanoate

Systemtic Name: [4-methoxy-1-octyl-2-oxidanylidene-7-[[(E)-3-phenylprop-2-enoyl]amino]quinolin-3-yl] ethanoate Openeye Name: [4-methoxy-1-octyl-2-oxo-7-[[(E)-3-phenylprop-2-enoyl]amino]-3-quinolyl] acetate CAS Name: acetic acid [4-methoxy-1-octyl-2-oxo-7-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-3-quinolinyl] ester IUPAC Name: [4-methoxy-1-octyl-2-oxo-7-[[(E)-3-phenylprop-2-enoyl]amino]quinolin-3-yl] acetate Traditional Name: acetic acid [2-keto-4-methoxy-1-octyl-7-[[(E)-3-phenylacryloyl]amino]-3-quinolyl] ester Formula: C29H34N2O5 MolecularWeight: 490.59066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)NC(=O)C=CC3=CC=CC=C3)C(=C(C1=O)OC(=O)C)OC

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)NC(=O)/C=C/C3=CC=CC=C3)C(=C(C1=O)OC(=O)C)OC

InChI

InChI=1S/C29H34N2O5/c1-4-5-6-7-8-12-19-31-25-20-23(30-26(33)18-15-22-13-10-9-11-14-22)16-17-24(25)27(35-3)28(29(31)34)36-21(2)32/h9-11,13-18,20H,4-8,12,19H2,1-3H3,(H,30,33)/b18-15+