O4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[2-(4-butylanilino)-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-(4-butylanilino)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-(4-butylanilino)-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-(4-butylanilino)-2-keto-ethyl] ester O1-ethyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C=CC(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C18H23NO5/c1-3-5-6-14-7-9-15(10-8-14)19-16(20)13-24-18(22)12-11-17(21)23-4-2/h7-12H,3-6,13H2,1-2H3,(H,19,20)/b12-11+