(2-nitrophenyl)methyl 2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (2-nitrophenyl)methyl 2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-nitrophenyl)methyl 2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(cyclopropylamino)-2-oxoethyl]thio]benzoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 2-[2-(cyclopropylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]benzoic acid (2-nitrobenzyl) ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CSC2=CC=CC=C2C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)CSC2=CC=CC=C2C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O5S/c22-18(20-14-9-10-14)12-27-17-8-4-2-6-15(17)19(23)26-11-13-5-1-3-7-16(13)21(24)25/h1-8,14H,9-12H2,(H,20,22)