carboxy-[[2-[methyl-(phenylmethyl)amino]-5-nitro-phenyl]methyl]carbamic acid

Systemtic Name: carboxy-[[2-[methyl-(phenylmethyl)amino]-5-nitro-phenyl]methyl]carbamic acid Openeye Name: [2-[benzyl(methyl)amino]-5-nitro-phenyl]methyl-carboxy-carbamic acid CAS Name: carboxy-[[2-[methyl-(phenylmethyl)amino]-5-nitrophenyl]methyl]carbamic acid IUPAC Name: [2-[benzyl(methyl)amino]-5-nitrophenyl]methyl-carboxycarbamic acid Traditional Name: [2-[benzyl(methyl)amino]-5-nitro-benzyl]-carboxy-carbamic acid Formula: C17H17N3O6 MolecularWeight: 359.33338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O6/c1-18(10-12-5-3-2-4-6-12)15-8-7-14(20(25)26)9-13(15)11-19(16(21)22)17(23)24/h2-9H,10-11H2,1H3,(H,21,22)(H,23,24)