(phenylmethyl) N-(1-oxidanidylpyridin-1-ium-2-yl)-N-(3-oxidanylpropyl)carbamate

Systemtic Name: (phenylmethyl) N-(1-oxidanidylpyridin-1-ium-2-yl)-N-(3-oxidanylpropyl)carbamate Openeye Name: benzyl N-(3-hydroxypropyl)-N-(1-oxidopyridin-1-ium-2-yl)carbamate CAS Name: N-(3-hydroxypropyl)-N-(1-oxido-2-pyridin-1-iumyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(3-hydroxypropyl)-N-(1-oxidopyridin-1-ium-2-yl)carbamate Traditional Name: N-(3-hydroxypropyl)-N-(1-oxidopyridin-1-ium-2-yl)carbamic acid benzyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(CCCO)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(CCCO)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H18N2O4/c19-12-6-10-17(15-9-4-5-11-18(15)21)16(20)22-13-14-7-2-1-3-8-14/h1-5,7-9,11,19H,6,10,12-13H2