methyl 2-[2-(2-nitrophenyl)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2-nitrophenyl)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: methyl 5-isopropyl-2-[[2-(2-nitrophenyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-(2-nitrophenyl)-1-oxoethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-nitrophenyl)acetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[[2-(2-nitrophenyl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)CC2=CC=CC=C2[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)CC2=CC=CC=C2[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H18N2O5S/c1-10(2)14-9-12(17(21)24-3)16(25-14)18-15(20)8-11-6-4-5-7-13(11)19(22)23/h4-7,9-10H,8H2,1-3H3,(H,18,20)