1-[(1R)-2-(aminocarbonylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1R)-2-(aminocarbonylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[(1R)-2-oxo-1-phenyl-2-ureido-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1R)-2-(carbamoylamino)-2-oxo-1-phenylethyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[(1R)-2-(carbamoylamino)-2-oxo-1-phenylethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[(1R)-2-keto-1-phenyl-2-ureido-ethyl]piperidin-1-ium-4-carboxamide Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)NC(=O)N

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)[C@H](C3=CC=CC=C3)C(=O)NC(=O)N

InChI

InChI=1S/C22H26N4O3/c23-22(29)25-21(28)19(17-9-5-2-6-10-17)26-13-11-18(12-14-26)20(27)24-15-16-7-3-1-4-8-16/h1-10,18-19H,11-15H2,(H,24,27)(H3,23,25,28,29)/p+1/t19-/m1/s1