2-[2-[aminocarbonyl-(3,4-dichlorophenyl)amino]-2-methyl-3-phenoxy-propanoyl]piperidine-2-carboxylic acid

Systemtic Name: 2-[2-[aminocarbonyl-(3,4-dichlorophenyl)amino]-2-methyl-3-phenoxy-propanoyl]piperidine-2-carboxylic acid Openeye Name: 2-[2-(N-carbamoyl-3,4-dichloro-anilino)-2-methyl-3-phenoxy-propanoyl]piperidine-2-carboxylic acid CAS Name: 2-[2-(N-carbamoyl-3,4-dichloroanilino)-2-methyl-1-oxo-3-phenoxypropyl]-2-piperidinecarboxylic acid IUPAC Name: 2-[2-(N-carbamoyl-3,4-dichloroanilino)-2-methyl-3-phenoxypropanoyl]piperidine-2-carboxylic acid Traditional Name: 2-[2-(N-carbamoyl-3,4-dichloro-anilino)-2-methyl-3-phenoxy-propanoyl]pipecolinic acid Formula: C23H25Cl2N3O5 MolecularWeight: 494.3677

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)(C(=O)C2(CCCCN2)C(=O)O)N(C3=CC(=C(C=C3)Cl)Cl)C(=O)N

Isomeric SMILES

CC(COC1=CC=CC=C1)(C(=O)C2(CCCCN2)C(=O)O)N(C3=CC(=C(C=C3)Cl)Cl)C(=O)N

InChI

InChI=1S/C23H25Cl2N3O5/c1-22(14-33-16-7-3-2-4-8-16,19(29)23(20(30)31)11-5-6-12-27-23)28(21(26)32)15-9-10-17(24)18(25)13-15/h2-4,7-10,13,27H,5-6,11-12,14H2,1H3,(H2,26,32)(H,30,31)