(E)-3-[bis[(4-methoxyphenyl)methyl]carbamoyloxy]-2-oxidanyl-prop-1-ene-1-diazonium

Systemtic Name: (E)-3-[bis[(4-methoxyphenyl)methyl]carbamoyloxy]-2-oxidanyl-prop-1-ene-1-diazonium Openeye Name: (E)-3-[bis[(4-methoxyphenyl)methyl]carbamoyloxy]-2-hydroxy-prop-1-ene-1-diazonium CAS Name: (E)-3-[[bis[(4-methoxyphenyl)methyl]amino]-oxomethoxy]-2-hydroxy-1-propene-1-diazonium IUPAC Name: (E)-3-[bis[(4-methoxyphenyl)methyl]carbamoyloxy]-2-hydroxyprop-1-ene-1-diazonium Traditional Name: (E)-3-[bis(p-anisyl)carbamoyloxy]-2-hydroxy-prop-1-ene-1-diazonium Formula: C20H22N3O5+ MolecularWeight: 384.40578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OC)C(=O)OCC(=C[N+]#N)O

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OC)C(=O)OC/C(=C\[N+]#N)/O

InChI

InChI=1S/C20H21N3O5/c1-26-18-7-3-15(4-8-18)12-23(20(25)28-14-17(24)11-22-21)13-16-5-9-19(27-2)10-6-16/h3-11H,12-14H2,1-2H3/p+1/b17-11+