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

Systemtic Name: tert-butyl N-[1-[butan-2-yl-[1-(2-ethynylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]amino]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[[1-(2-ethynylphenyl)-2-(4-methoxyanilino)-2-oxo-ethyl]-sec-butyl-amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[1-[butan-2-yl-[1-(2-ethynylphenyl)-2-(4-methoxyanilino)-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[butan-2-yl-[1-(2-ethynylphenyl)-2-(4-methoxyanilino)-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[[1-(2-ethynylphenyl)-2-keto-2-(p-anisidino)ethyl]-sec-butyl-amino]-1-(4-hydroxybenzyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C35H41N3O6 MolecularWeight: 599.71654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C1=CC=CC=C1C#C)C(=O)NC2=CC=C(C=C2)OC)C(=O)C(CC3=CC=C(C=C3)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)N(C(C1=CC=CC=C1C#C)C(=O)NC2=CC=C(C=C2)OC)C(=O)C(CC3=CC=C(C=C3)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C35H41N3O6/c1-8-23(3)38(33(41)30(37-34(42)44-35(4,5)6)22-24-14-18-27(39)19-15-24)31(29-13-11-10-12-25(29)9-2)32(40)36-26-16-20-28(43-7)21-17-26/h2,10-21,23,30-31,39H,8,22H2,1,3-7H3,(H,36,40)(H,37,42)