tert-butyl N-[2-[5-(3-methylbutylamino)-5-oxidanylidene-pentyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-[5-(3-methylbutylamino)-5-oxidanylidene-pentyl]phenyl]carbamate Openeye Name: tert-butyl N-[2-[5-(isopentylamino)-5-oxo-pentyl]phenyl]carbamate CAS Name: N-[2-[5-(3-methylbutylamino)-5-oxopentyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[5-(3-methylbutylamino)-5-oxopentyl]phenyl]carbamate Traditional Name: N-[2-[5-(isoamylamino)-5-keto-pentyl]phenyl]carbamic acid tert-butyl ester Formula: C21H34N2O3 MolecularWeight: 362.50626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CCCCC1=CC=CC=C1NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCNC(=O)CCCCC1=CC=CC=C1NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H34N2O3/c1-16(2)14-15-22-19(24)13-9-7-11-17-10-6-8-12-18(17)23-20(25)26-21(3,4)5/h6,8,10,12,16H,7,9,11,13-15H2,1-5H3,(H,22,24)(H,23,25)