2-[[methyl-(4-methyl-3-nitro-phenyl)carbonyl-carbamoyl]amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[[methyl-(4-methyl-3-nitro-phenyl)carbonyl-carbamoyl]amino]-2-phenyl-ethanoic acid Openeye Name: 2-[[methyl-(4-methyl-3-nitro-benzoyl)carbamoyl]amino]-2-phenyl-acetic acid CAS Name: 2-[[[methyl-[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[[methyl-(4-methyl-3-nitrobenzoyl)carbamoyl]amino]-2-phenylacetic acid Traditional Name: 2-[[methyl-(4-methyl-3-nitro-benzoyl)carbamoyl]amino]-2-phenyl-acetic acid Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O6/c1-11-8-9-13(10-14(11)21(26)27)16(22)20(2)18(25)19-15(17(23)24)12-6-4-3-5-7-12/h3-10,15H,1-2H3,(H,19,25)(H,23,24)