2-[[2-(4-nitrophenyl)carbonylhydrazinyl]-phenyl-methyl]sulfanylethanoic acid

Systemtic Name: 2-[[2-(4-nitrophenyl)carbonylhydrazinyl]-phenyl-methyl]sulfanylethanoic acid Openeye Name: 2-[[2-(4-nitrobenzoyl)hydrazino]-phenyl-methyl]sulfanylacetic acid CAS Name: 2-[[[[(4-nitrophenyl)-oxomethyl]hydrazo]-phenylmethyl]thio]acetic acid IUPAC Name: 2-[[2-(4-nitrobenzoyl)hydrazinyl]-phenylmethyl]sulfanylacetic acid Traditional Name: 2-[[[N'-(4-nitrobenzoyl)hydrazino]-phenyl-methyl]thio]acetic acid Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])SCC(=O)O

InChI

InChI=1S/C16H15N3O5S/c20-14(21)10-25-16(12-4-2-1-3-5-12)18-17-15(22)11-6-8-13(9-7-11)19(23)24/h1-9,16,18H,10H2,(H,17,22)(H,20,21)