tert-butyl N-[[4-[2-(3-methylbutylcarbamoyl)phenyl]pyridin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[2-(3-methylbutylcarbamoyl)phenyl]pyridin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[2-(isopentylcarbamoyl)phenyl]-3-pyridyl]methyl]carbamate CAS Name: N-[[4-[2-[(3-methylbutylamino)-oxomethyl]phenyl]-3-pyridinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[2-(3-methylbutylcarbamoyl)phenyl]pyridin-3-yl]methyl]carbamate Traditional Name: N-[[4-[2-(isoamylcarbamoyl)phenyl]-3-pyridyl]methyl]carbamic acid tert-butyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=CC=C1C2=C(C=NC=C2)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=CC=C1C2=C(C=NC=C2)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C23H31N3O3/c1-16(2)10-13-25-21(27)20-9-7-6-8-19(20)18-11-12-24-14-17(18)15-26-22(28)29-23(3,4)5/h6-9,11-12,14,16H,10,13,15H2,1-5H3,(H,25,27)(H,26,28)