methyl 3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[(E)-3-(3-nitrophenyl)acryloyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5S/c1-24-17(21)11-14(15-6-3-9-25-15)18-16(20)8-7-12-4-2-5-13(10-12)19(22)23/h2-10,14H,11H2,1H3,(H,18,20)/b8-7+