propan-2-yl 4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]-2-methyl-quinoline-6-carboxylate

Systemtic Name: propan-2-yl 4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]-2-methyl-quinoline-6-carboxylate Openeye Name: isopropyl 4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]-2-methyl-quinoline-6-carboxylate CAS Name: 4-[[(E)-3-(4-ethylphenyl)-1-oxoprop-2-enyl]amino]-2-methyl-6-quinolinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]-2-methylquinoline-6-carboxylate Traditional Name: 4-[[(E)-3-(4-ethylphenyl)acryloyl]amino]-2-methyl-quinoline-6-carboxylic acid isopropyl ester Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC(=O)NC2=CC(=NC3=C2C=C(C=C3)C(=O)OC(C)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C(=O)NC2=CC(=NC3=C2C=C(C=C3)C(=O)OC(C)C)C

InChI

InChI=1S/C25H26N2O3/c1-5-18-6-8-19(9-7-18)10-13-24(28)27-23-14-17(4)26-22-12-11-20(15-21(22)23)25(29)30-16(2)3/h6-16H,5H2,1-4H3,(H,26,27,28)/b13-10+