tert-butyl 4-[4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]piperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]piperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(3-chloro-4-methyl-phenyl)carbamoyl]piperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 4-[[4-[(3-chloro-4-methylanilino)-oxomethyl]-1-piperazinyl]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(3-chloro-4-methylphenyl)carbamoyl]piperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 4-[4-[(3-chloro-4-methyl-phenyl)carbamoyl]piperazine-1-carbonyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H33ClN4O4 MolecularWeight: 464.98552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C23H33ClN4O4/c1-16-5-6-18(15-19(16)24)25-21(30)27-13-11-26(12-14-27)20(29)17-7-9-28(10-8-17)22(31)32-23(2,3)4/h5-6,15,17H,7-14H2,1-4H3,(H,25,30)