tert-butyl N-[[1-(3-bromophenyl)carbonylpiperidin-3-yl]methyl]-N-propan-2-yl-carbamate

Systemtic Name: tert-butyl N-[[1-(3-bromophenyl)carbonylpiperidin-3-yl]methyl]-N-propan-2-yl-carbamate Openeye Name: tert-butyl N-[[1-(3-bromobenzoyl)-3-piperidyl]methyl]-N-isopropyl-carbamate CAS Name: N-[[1-[(3-bromophenyl)-oxomethyl]-3-piperidinyl]methyl]-N-propan-2-ylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[1-(3-bromobenzoyl)piperidin-3-yl]methyl]-N-propan-2-ylcarbamate Traditional Name: N-[[1-(3-bromobenzoyl)-3-piperidyl]methyl]-N-isopropyl-carbamic acid tert-butyl ester Formula: C21H31BrN2O3 MolecularWeight: 439.38644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1CCCN(C1)C(=O)C2=CC(=CC=C2)Br)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)N(CC1CCCN(C1)C(=O)C2=CC(=CC=C2)Br)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31BrN2O3/c1-15(2)24(20(26)27-21(3,4)5)14-16-8-7-11-23(13-16)19(25)17-9-6-10-18(22)12-17/h6,9-10,12,15-16H,7-8,11,13-14H2,1-5H3