4-acetamido-1-[2-[2,3-bis(chloranyl)phenyl]prop-2-enoyl]piperidine-4-carboxylic acid

Systemtic Name: 4-acetamido-1-[2-[2,3-bis(chloranyl)phenyl]prop-2-enoyl]piperidine-4-carboxylic acid Openeye Name: 4-acetamido-1-[2-(2,3-dichlorophenyl)prop-2-enoyl]piperidine-4-carboxylic acid CAS Name: 4-acetamido-1-[2-(2,3-dichlorophenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid IUPAC Name: 4-acetamido-1-[2-(2,3-dichlorophenyl)prop-2-enoyl]piperidine-4-carboxylic acid Traditional Name: 4-acetamido-1-[2-(2,3-dichlorophenyl)acryloyl]isonipecotic acid Formula: C17H18Cl2N2O4 MolecularWeight: 385.24182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CCN(CC1)C(=O)C(=C)C2=C(C(=CC=C2)Cl)Cl)C(=O)O

Isomeric SMILES

CC(=O)NC1(CCN(CC1)C(=O)C(=C)C2=C(C(=CC=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H18Cl2N2O4/c1-10(12-4-3-5-13(18)14(12)19)15(23)21-8-6-17(7-9-21,16(24)25)20-11(2)22/h3-5H,1,6-9H2,2H3,(H,20,22)(H,24,25)