tert-butyl 4-[(2-methyl-4-pyrrolidin-1-yl-phenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2-methyl-4-pyrrolidin-1-yl-phenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-methyl-4-pyrrolidin-1-yl-phenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[2-methyl-4-(1-pyrrolidinyl)anilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-methyl-4-pyrrolidin-1-ylphenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(2-methyl-4-pyrrolidino-phenyl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33N3O3/c1-16-15-18(24-11-5-6-12-24)7-8-19(16)23-20(26)17-9-13-25(14-10-17)21(27)28-22(2,3)4/h7-8,15,17H,5-6,9-14H2,1-4H3,(H,23,26)