[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-thiophen-3-ylprop-2-enoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C=CC2=CSC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)/C=C/C2=CSC=C2

InChI

InChI=1S/C19H21NO3S/c1-2-3-4-15-5-8-17(9-6-15)20-18(21)13-23-19(22)10-7-16-11-12-24-14-16/h5-12,14H,2-4,13H2,1H3,(H,20,21)/b10-7+