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

Systemtic Name: tert-butyl N-[(2R)-3-(4-hydroxyphenyl)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[(1R)-1-[(4-hydroxyphenyl)methyl]-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-N-methyl-carbamate CAS Name: N-[(2R)-3-(4-hydroxyphenyl)-1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-3-(4-hydroxyphenyl)-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]-N-methylcarbamate Traditional Name: N-[(1R)-1-(4-hydroxybenzyl)-2-keto-2-(4-phenylpiperazino)ethyl]-N-methyl-carbamic acid tert-butyl ester Formula: C25H33N3O4 MolecularWeight: 439.54722

Click to see the large picture

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=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(C)[C@H](CC1=CC=C(C=C1)O)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O4/c1-25(2,3)32-24(31)26(4)22(18-19-10-12-21(29)13-11-19)23(30)28-16-14-27(15-17-28)20-8-6-5-7-9-20/h5-13,22,29H,14-18H2,1-4H3/t22-/m1/s1