tert-butyl N-[(3-piperidin-1-ylphenyl)methyl]carbamate; ethanoic acid

Systemtic Name: tert-butyl N-[(3-piperidin-1-ylphenyl)methyl]carbamate; ethanoic acid Openeye Name: acetic acid; tert-butyl N-[[3-(1-piperidyl)phenyl]methyl]carbamate CAS Name: acetic acid; N-[[3-(1-piperidinyl)phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: acetic acid; tert-butyl N-[(3-piperidin-1-ylphenyl)methyl]carbamate Traditional Name: acetic acid; N-(3-piperidinobenzyl)carbamic acid tert-butyl ester Formula: C19H30N2O4 MolecularWeight: 350.4525

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(C)(C)OC(=O)NCC1=CC(=CC=C1)N2CCCCC2

Isomeric SMILES

CC(=O)O.CC(C)(C)OC(=O)NCC1=CC(=CC=C1)N2CCCCC2

InChI

InChI=1S/C17H26N2O2.C2H4O2/c1-17(2,3)21-16(20)18-13-14-8-7-9-15(12-14)19-10-5-4-6-11-19;1-2(3)4/h7-9,12H,4-6,10-11,13H2,1-3H3,(H,18,20);1H3,(H,3,4)