tert-butyl N-[1-[4-(4-cyanophenyl)piperazin-1-yl]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[1-[4-(4-cyanophenyl)piperazin-1-yl]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[2-[4-(4-cyanophenyl)piperazin-1-yl]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]-N-methyl-carbamate CAS Name: N-[1-[4-(4-cyanophenyl)-1-piperazinyl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-(4-cyanophenyl)piperazin-1-yl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-N-methylcarbamate Traditional Name: N-[2-[4-(4-cyanophenyl)piperazino]-1-(4-hydroxybenzyl)-2-keto-ethyl]-N-methyl-carbamic acid tert-butyl ester Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C(CC1=CC=C(C=C1)O)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C(CC1=CC=C(C=C1)O)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H32N4O4/c1-26(2,3)34-25(33)28(4)23(17-19-7-11-22(31)12-8-19)24(32)30-15-13-29(14-16-30)21-9-5-20(18-27)6-10-21/h5-12,23,31H,13-17H2,1-4H3