tert-butyl N-[3-(4-hydroxyphenyl)-1-[[1-(2-methylphenyl)-2-oxidanylidene-2-(propan-2-ylamino)ethyl]-pentyl-amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(4-hydroxyphenyl)-1-[[1-(2-methylphenyl)-2-oxidanylidene-2-(propan-2-ylamino)ethyl]-pentyl-amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(4-hydroxyphenyl)methyl]-2-[[2-(isopropylamino)-1-(o-tolyl)-2-oxo-ethyl]-pentyl-amino]-2-oxo-ethyl]carbamate CAS Name: N-[3-(4-hydroxyphenyl)-1-[[1-(2-methylphenyl)-2-oxo-2-(propan-2-ylamino)ethyl]-pentylamino]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(4-hydroxyphenyl)-1-[[1-(2-methylphenyl)-2-oxo-2-(propan-2-ylamino)ethyl]-pentylamino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[amyl-[2-(isopropylamino)-2-keto-1-(o-tolyl)ethyl]amino]-1-(4-hydroxybenzyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C31H45N3O5 MolecularWeight: 539.7061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(C1=CC=CC=C1C)C(=O)NC(C)C)C(=O)C(CC2=CC=C(C=C2)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCN(C(C1=CC=CC=C1C)C(=O)NC(C)C)C(=O)C(CC2=CC=C(C=C2)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C31H45N3O5/c1-8-9-12-19-34(27(28(36)32-21(2)3)25-14-11-10-13-22(25)4)29(37)26(33-30(38)39-31(5,6)7)20-23-15-17-24(35)18-16-23/h10-11,13-18,21,26-27,35H,8-9,12,19-20H2,1-7H3,(H,32,36)(H,33,38)