tert-butyl 4-(2-methoxyphenyl)piperazine-1-carboxylate; 3-methylpiperidine-4-carboxamide

Systemtic Name: tert-butyl 4-(2-methoxyphenyl)piperazine-1-carboxylate; 3-methylpiperidine-4-carboxamide Openeye Name: tert-butyl 4-(2-methoxyphenyl)piperazine-1-carboxylate; 3-methylpiperidine-4-carboxamide CAS Name: 4-(2-methoxyphenyl)-1-piperazinecarboxylic acid tert-butyl ester; 3-methyl-4-piperidinecarboxamide IUPAC Name: tert-butyl 4-(2-methoxyphenyl)piperazine-1-carboxylate; 3-methylpiperidine-4-carboxamide Traditional Name: 4-(2-methoxyphenyl)piperazine-1-carboxylic acid tert-butyl ester; 3-methylisonipecotamide Formula: C23H38N4O4 MolecularWeight: 434.57222

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCC1C(=O)N.CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC=C2OC

Isomeric SMILES

CC1CNCCC1C(=O)N.CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC=C2OC

InChI

InChI=1S/C16H24N2O3.C7H14N2O/c1-16(2,3)21-15(19)18-11-9-17(10-12-18)13-7-5-6-8-14(13)20-4;1-5-4-9-3-2-6(5)7(8)10/h5-8H,9-12H2,1-4H3;5-6,9H,2-4H2,1H3,(H2,8,10)