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

Systemtic Name: tert-butyl N-[1-[butan-2-yl-[1-(4-ethylphenyl)-2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[[1-(4-ethylphenyl)-2-(isopropylamino)-2-oxo-ethyl]-sec-butyl-amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[1-[butan-2-yl-[1-(4-ethylphenyl)-2-oxo-2-(propan-2-ylamino)ethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[butan-2-yl-[1-(4-ethylphenyl)-2-oxo-2-(propan-2-ylamino)ethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[[1-(4-ethylphenyl)-2-(isopropylamino)-2-keto-ethyl]-sec-butyl-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:

CCC1=CC=C(C=C1)C(C(=O)NC(C)C)N(C(C)CC)C(=O)C(CC2=CC=C(C=C2)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C(=O)NC(C)C)N(C(C)CC)C(=O)C(CC2=CC=C(C=C2)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C31H45N3O5/c1-9-21(5)34(27(28(36)32-20(3)4)24-15-11-22(10-2)12-16-24)29(37)26(33-30(38)39-31(6,7)8)19-23-13-17-25(35)18-14-23/h11-18,20-21,26-27,35H,9-10,19H2,1-8H3,(H,32,36)(H,33,38)