tert-butyl 4-phenyl-4-[(Z)-N'-(3-phenylpropanoyloxy)carbamimidoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-phenyl-4-[(Z)-N'-(3-phenylpropanoyloxy)carbamimidoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-phenyl-4-[(Z)-N'-(3-phenylpropanoyloxy)carbamimidoyl]piperidine-1-carboxylate CAS Name: 4-[(Z)-amino-(1-oxo-3-phenylpropoxy)iminomethyl]-4-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-phenyl-4-[(Z)-N'-(3-phenylpropanoyloxy)carbamimidoyl]piperidine-1-carboxylate Traditional Name: 4-[(Z)-N'-hydrocinnamoyloxyamidino]-4-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=NOC(=O)CCC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)/C(=N/OC(=O)CCC3=CC=CC=C3)/N

InChI

InChI=1S/C26H33N3O4/c1-25(2,3)32-24(31)29-18-16-26(17-19-29,21-12-8-5-9-13-21)23(27)28-33-22(30)15-14-20-10-6-4-7-11-20/h4-13H,14-19H2,1-3H3,(H2,27,28)