1-[(3-chloranyl-4-methyl-phenyl)carbamoyl]piperidine-4-carboxylate

Systemtic Name: 1-[(3-chloranyl-4-methyl-phenyl)carbamoyl]piperidine-4-carboxylate Openeye Name: 1-[(3-chloro-4-methyl-phenyl)carbamoyl]piperidine-4-carboxylate CAS Name: 1-[(3-chloro-4-methylanilino)-oxomethyl]-4-piperidinecarboxylate IUPAC Name: 1-[(3-chloro-4-methylphenyl)carbamoyl]piperidine-4-carboxylate Traditional Name: 1-[(3-chloro-4-methyl-phenyl)carbamoyl]isonipecotate Formula: C14H16ClN2O3- MolecularWeight: 295.74144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCC(CC2)C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCC(CC2)C(=O)[O-])Cl

InChI

InChI=1S/C14H17ClN2O3/c1-9-2-3-11(8-12(9)15)16-14(20)17-6-4-10(5-7-17)13(18)19/h2-3,8,10H,4-7H2,1H3,(H,16,20)(H,18,19)/p-1