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

Systemtic Name: 2-[4-[methyl-[(3-methyl-4-nitro-phenyl)methoxycarbonyl]amino]phenyl]ethanoic acid Openeye Name: 2-[4-[methyl-[(3-methyl-4-nitro-phenyl)methoxycarbonyl]amino]phenyl]acetic acid CAS Name: 2-[4-[methyl-[(3-methyl-4-nitrophenyl)methoxy-oxomethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[methyl-[(3-methyl-4-nitrophenyl)methoxycarbonyl]amino]phenyl]acetic acid Traditional Name: 2-[4-[methyl-(3-methyl-4-nitro-benzyl)oxycarbonyl-amino]phenyl]acetic acid Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6/c1-12-9-14(5-8-16(12)20(24)25)11-26-18(23)19(2)15-6-3-13(4-7-15)10-17(21)22/h3-9H,10-11H2,1-2H3,(H,21,22)