N-(3-methylphenyl)-2-nitro-benzamide hydrate

Systemtic Name: N-(3-methylphenyl)-2-nitro-benzamide hydrate Openeye Name: N-(m-tolyl)-2-nitro-benzamide hydrate CAS Name: N-(3-methylphenyl)-2-nitrobenzamide hydrate IUPAC Name: N-(3-methylphenyl)-2-nitrobenzamide hydrate Traditional Name: N-(m-tolyl)-2-nitro-benzamide hydrate Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O3.H2O/c1-10-5-4-6-11(9-10)15-14(17)12-7-2-3-8-13(12)16(18)19;/h2-9H,1H3,(H,15,17);1H2