ethyl 2-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]propanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enoxy]-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]propanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-[3-(1,3-benzodioxol-5-yl)acryloyl]oxypropanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H23NO7S MolecularWeight: 493.52832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)OC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)OC(=O)C=CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H23NO7S/c1-3-31-26(30)19-14-22(18-7-5-4-6-8-18)35-25(19)27-24(29)16(2)34-23(28)12-10-17-9-11-20-21(13-17)33-15-32-20/h4-14,16H,3,15H2,1-2H3,(H,27,29)