2-azanyl-2-[5-(4-methylphenyl)carbonyl-2-nitro-phenyl]propanoic acid

Systemtic Name: 2-azanyl-2-[5-(4-methylphenyl)carbonyl-2-nitro-phenyl]propanoic acid Openeye Name: 2-amino-2-[5-(4-methylbenzoyl)-2-nitro-phenyl]propanoic acid CAS Name: 2-amino-2-[5-[(4-methylphenyl)-oxomethyl]-2-nitrophenyl]propanoic acid IUPAC Name: 2-amino-2-[5-(4-methylbenzoyl)-2-nitrophenyl]propanoic acid Traditional Name: 2-amino-2-(2-nitro-5-p-toluoyl-phenyl)propionic acid Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5/c1-10-3-5-11(6-4-10)15(20)12-7-8-14(19(23)24)13(9-12)17(2,18)16(21)22/h3-9H,18H2,1-2H3,(H,21,22)