ethyl 4-methyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonyloxymethyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonyloxymethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]oxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[oxo-[1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinyl]methoxy]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]oxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[1-[(E)-3-phenylacryloyl]isonipecotoyl]oxymethyl]quinoline-3-carboxylic acid ethyl ester Formula: C29H30N2O5 MolecularWeight: 486.5589

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)C

InChI

InChI=1S/C29H30N2O5/c1-3-35-29(34)27-20(2)23-11-7-8-12-24(23)30-25(27)19-36-28(33)22-15-17-31(18-16-22)26(32)14-13-21-9-5-4-6-10-21/h4-14,22H,3,15-19H2,1-2H3/b14-13+