[2-[[4-(3-methylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [2-[[4-(3-methylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [2-[4-(3-methylphenoxy)anilino]-2-oxo-ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [2-[4-(3-methylphenoxy)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-methylphenoxy)anilino]-2-oxoethyl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [2-keto-2-[4-(3-methylphenoxy)anilino]ethyl] ester Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)COC(=O)C=CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)COC(=O)/C=C/C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C27H22N2O4/c1-19-5-2-9-24(17-19)33-23-13-11-22(12-14-23)29-25(30)18-32-26(31)15-10-21-7-3-6-20-8-4-16-28-27(20)21/h2-17H,18H2,1H3,(H,29,30)/b15-10+