[(E)-C-(4-indol-1-ylpiperidin-1-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbonimidoyl]carbamic acid

Systemtic Name: [(E)-C-(4-indol-1-ylpiperidin-1-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbonimidoyl]carbamic acid Openeye Name: [(E)-N-tert-butoxycarbonyl-C-(4-indol-1-yl-1-piperidyl)carbonimidoyl]carbamic acid CAS Name: [(E)-[4-(1-indolyl)-1-piperidinyl]-[(2-methylpropan-2-yl)oxy-oxomethyl]iminomethyl]carbamic acid IUPAC Name: [(E)-C-(4-indol-1-ylpiperidin-1-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbonimidoyl]carbamic acid Traditional Name: [(E)-N-tert-butoxycarbonyl-C-(4-indol-1-ylpiperidino)carbonimidoyl]carbamic acid Formula: C20H26N4O4 MolecularWeight: 386.44484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(NC(=O)O)N1CCC(CC1)N2C=CC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)/N=C(\NC(=O)O)/N1CCC(CC1)N2C=CC3=CC=CC=C32

InChI

InChI=1S/C20H26N4O4/c1-20(2,3)28-19(27)22-17(21-18(25)26)23-11-9-15(10-12-23)24-13-8-14-6-4-5-7-16(14)24/h4-8,13,15H,9-12H2,1-3H3,(H,25,26)(H,21,22,27)