ethyl 2-[(4-nitrophenyl)carbonylamino]-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-nitrophenyl)carbonylamino]-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O5S/c1-2-28-21(25)18-13-17(12-14-6-4-3-5-7-14)29-20(18)22-19(24)15-8-10-16(11-9-15)23(26)27/h3-11,13H,2,12H2,1H3,(H,22,24)