[1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(5-methylfuran-2-yl)prop-2-enoate

Systemtic Name: [1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(5-methylfuran-2-yl)prop-2-enoate Openeye Name: [1-methyl-2-oxo-2-(2-sec-butylanilino)ethyl] (E)-3-(5-methyl-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-methyl-2-furanyl)-2-propenoic acid [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] (E)-3-(5-methylfuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-methyl-2-furyl)acrylic acid [2-keto-1-methyl-2-(2-sec-butylanilino)ethyl] ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)C=CC2=CC=C(O2)C

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)/C=C/C2=CC=C(O2)C

InChI

InChI=1S/C21H25NO4/c1-5-14(2)18-8-6-7-9-19(18)22-21(24)16(4)26-20(23)13-12-17-11-10-15(3)25-17/h6-14,16H,5H2,1-4H3,(H,22,24)/b13-12+