(phenylmethyl) 4-[(Z)-N'-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enoxy]carbamimidoyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(Z)-N'-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enoxy]carbamimidoyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[(Z)-N'-[(E)-3-ethoxy-3-oxo-prop-1-enoxy]carbamimidoyl]piperidine-1-carboxylate CAS Name: 4-[(Z)-amino-[(E)-3-ethoxy-3-oxoprop-1-enoxy]iminomethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(Z)-N'-[(E)-3-ethoxy-3-oxoprop-1-enoxy]carbamimidoyl]piperidine-1-carboxylate Traditional Name: 4-[(Z)-N'-[(E)-3-ethoxy-3-keto-prop-1-enoxy]amidino]piperidine-1-carboxylic acid benzyl ester Formula: C19H25N3O5 MolecularWeight: 375.4189

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CON=C(C1CCN(CC1)C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)/C=C/O/N=C(/C1CCN(CC1)C(=O)OCC2=CC=CC=C2)\N

InChI

InChI=1S/C19H25N3O5/c1-2-25-17(23)10-13-27-21-18(20)16-8-11-22(12-9-16)19(24)26-14-15-6-4-3-5-7-15/h3-7,10,13,16H,2,8-9,11-12,14H2,1H3,(H2,20,21)/b13-10+