ethyl 2-[2-[3-[(4-nitrophenyl)carbonylamino]phenoxy]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-[(4-nitrophenyl)carbonylamino]phenoxy]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[3-[(4-nitrobenzoyl)amino]phenoxy]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[3-[[(4-nitrophenyl)-oxomethyl]amino]phenoxy]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-[(4-nitrobenzoyl)amino]phenoxy]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[3-[(4-nitrobenzoyl)amino]phenoxy]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C26H25N3O7S MolecularWeight: 523.5576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC=CC(=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC=CC(=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H25N3O7S/c1-2-35-26(32)23-20-8-3-4-9-21(20)37-25(23)28-22(30)15-36-19-7-5-6-17(14-19)27-24(31)16-10-12-18(13-11-16)29(33)34/h5-7,10-14H,2-4,8-9,15H2,1H3,(H,27,31)(H,28,30)