N-[2-azanyl-1-(4-methylphenyl)-2-oxidanylidene-ethyl]-N-(furan-2-ylmethyl)-3-nitro-benzamide

Systemtic Name: N-[2-azanyl-1-(4-methylphenyl)-2-oxidanylidene-ethyl]-N-(furan-2-ylmethyl)-3-nitro-benzamide Openeye Name: N-[2-amino-2-oxo-1-(p-tolyl)ethyl]-N-(2-furylmethyl)-3-nitro-benzamide CAS Name: N-[2-amino-1-(4-methylphenyl)-2-oxoethyl]-N-(2-furanylmethyl)-3-nitrobenzamide IUPAC Name: N-[2-amino-1-(4-methylphenyl)-2-oxoethyl]-N-(furan-2-ylmethyl)-3-nitrobenzamide Traditional Name: N-[2-amino-2-keto-1-(p-tolyl)ethyl]-N-(2-furfuryl)-3-nitro-benzamide Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)N)N(CC2=CC=CO2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)N)N(CC2=CC=CO2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5/c1-14-7-9-15(10-8-14)19(20(22)25)23(13-18-6-3-11-29-18)21(26)16-4-2-5-17(12-16)24(27)28/h2-12,19H,13H2,1H3,(H2,22,25)