N-[2-(4-aminophenyl)-2-oxidanyl-ethyl]-4-cyano-benzamide

Systemtic Name: N-[2-(4-aminophenyl)-2-oxidanyl-ethyl]-4-cyano-benzamide Openeye Name: N-[2-(4-aminophenyl)-2-hydroxy-ethyl]-4-cyano-benzamide CAS Name: N-[2-(4-aminophenyl)-2-hydroxyethyl]-4-cyanobenzamide IUPAC Name: N-[2-(4-aminophenyl)-2-hydroxyethyl]-4-cyanobenzamide Traditional Name: N-[2-(4-aminophenyl)-2-hydroxy-ethyl]-4-cyano-benzamide Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)NCC(C2=CC=C(C=C2)N)O

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)NCC(C2=CC=C(C=C2)N)O

InChI

InChI=1S/C16H15N3O2/c17-9-11-1-3-13(4-2-11)16(21)19-10-15(20)12-5-7-14(18)8-6-12/h1-8,15,20H,10,18H2,(H,19,21)