tert-butyl N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-(4-phenylpiperazin-1-yl)carbonimidoyl]-N-phenacyl-carbamate

Systemtic Name: tert-butyl N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-(4-phenylpiperazin-1-yl)carbonimidoyl]-N-phenacyl-carbamate Openeye Name: tert-butyl N-[(E)-N-tert-butoxycarbonyl-C-(4-phenylpiperazin-1-yl)carbonimidoyl]-N-phenacyl-carbamate CAS Name: N-[(E)-[(2-methylpropan-2-yl)oxy-oxomethyl]imino-(4-phenyl-1-piperazinyl)methyl]-N-phenacylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-(4-phenylpiperazin-1-yl)carbonimidoyl]-N-phenacylcarbamate Traditional Name: N-[(E)-N-tert-butoxycarbonyl-C-(4-phenylpiperazino)carbonimidoyl]-N-phenacyl-carbamic acid tert-butyl ester Formula: C29H38N4O5 MolecularWeight: 522.63582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(N1CCN(CC1)C2=CC=CC=C2)N(CC(=O)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)/N=C(\N1CCN(CC1)C2=CC=CC=C2)/N(CC(=O)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H38N4O5/c1-28(2,3)37-26(35)30-25(32-19-17-31(18-20-32)23-15-11-8-12-16-23)33(27(36)38-29(4,5)6)21-24(34)22-13-9-7-10-14-22/h7-16H,17-21H2,1-6H3/b30-25+