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

Systemtic Name: tert-butyl N-[1-[4-(4-bromanyl-2-methyl-phenyl)piperazin-1-yl]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[2-[4-(4-bromo-2-methyl-phenyl)piperazin-1-yl]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]-N-methyl-carbamate CAS Name: N-[1-[4-(4-bromo-2-methylphenyl)-1-piperazinyl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-(4-bromo-2-methylphenyl)piperazin-1-yl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-N-methylcarbamate Traditional Name: N-[2-[4-(4-bromo-2-methyl-phenyl)piperazino]-1-(4-hydroxybenzyl)-2-keto-ethyl]-N-methyl-carbamic acid tert-butyl ester Formula: C26H34BrN3O4 MolecularWeight: 532.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)N2CCN(CC2)C(=O)C(CC3=CC=C(C=C3)O)N(C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)N2CCN(CC2)C(=O)C(CC3=CC=C(C=C3)O)N(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H34BrN3O4/c1-18-16-20(27)8-11-22(18)29-12-14-30(15-13-29)24(32)23(17-19-6-9-21(31)10-7-19)28(5)25(33)34-26(2,3)4/h6-11,16,23,31H,12-15,17H2,1-5H3