[2-[2-[ethyl-(3-methylphenyl)amino]ethylamino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [2-[2-[ethyl-(3-methylphenyl)amino]ethylamino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [2-[2-(N-ethyl-3-methyl-anilino)ethylamino]-2-oxo-ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [2-[2-(N-ethyl-3-methylanilino)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(N-ethyl-3-methylanilino)ethylamino]-2-oxoethyl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [2-[2-(N-ethyl-3-methyl-anilino)ethylamino]-2-keto-ethyl] ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)COC(=O)C=CC1=CC=CC2=C1N=CC=C2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=O)COC(=O)/C=C/C1=CC=CC2=C1N=CC=C2)C3=CC=CC(=C3)C

InChI

InChI=1S/C25H27N3O3/c1-3-28(22-11-4-7-19(2)17-22)16-15-26-23(29)18-31-24(30)13-12-21-9-5-8-20-10-6-14-27-25(20)21/h4-14,17H,3,15-16,18H2,1-2H3,(H,26,29)/b13-12+