N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-4-(methylamino)-3-nitro-benzamide CAS Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-4-(methylamino)-3-nitrobenzamide Traditional Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-4-(methylamino)-3-nitro-benzamide Formula: C16H16ClN3O4 MolecularWeight: 349.76894

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NCC(C2=CC(=CC=C2)Cl)O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NCC(C2=CC(=CC=C2)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C16H16ClN3O4/c1-18-13-6-5-11(8-14(13)20(23)24)16(22)19-9-15(21)10-3-2-4-12(17)7-10/h2-8,15,18,21H,9H2,1H3,(H,19,22)