N-[5-(hydroxymethyl)-2-methyl-phenyl]-3-nitro-benzamide

Systemtic Name: N-[5-(hydroxymethyl)-2-methyl-phenyl]-3-nitro-benzamide Openeye Name: N-[5-(hydroxymethyl)-2-methyl-phenyl]-3-nitro-benzamide CAS Name: N-[5-(hydroxymethyl)-2-methylphenyl]-3-nitrobenzamide IUPAC Name: N-[5-(hydroxymethyl)-2-methylphenyl]-3-nitrobenzamide Traditional Name: N-(2-methyl-5-methylol-phenyl)-3-nitro-benzamide Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CO)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)CO)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4/c1-10-5-6-11(9-18)7-14(10)16-15(19)12-3-2-4-13(8-12)17(20)21/h2-8,18H,9H2,1H3,(H,16,19)