[[(E)-2-isocyano-1-[methyl(1H-pyrrol-2-ylmethyl)amino]ethenyl]-methyl-carbamoyl]oxymethyl ethanoate

Systemtic Name: [[(E)-2-isocyano-1-[methyl(1H-pyrrol-2-ylmethyl)amino]ethenyl]-methyl-carbamoyl]oxymethyl ethanoate Openeye Name: [[(E)-2-isocyano-1-[methyl(1H-pyrrol-2-ylmethyl)amino]vinyl]-methyl-carbamoyl]oxymethyl acetate CAS Name: acetic acid [[[(E)-2-isocyano-1-[methyl(1H-pyrrol-2-ylmethyl)amino]ethenyl]-methylamino]-oxomethoxy]methyl ester IUPAC Name: [[(E)-2-isocyano-1-[methyl(1H-pyrrol-2-ylmethyl)amino]ethenyl]-methylcarbamoyl]oxymethyl acetate Traditional Name: acetic acid [[(E)-2-isocyano-1-[methyl(1H-pyrrol-2-ylmethyl)amino]vinyl]-methyl-carbamoyl]oxymethyl ester Formula: C14H18N4O4 MolecularWeight: 306.31712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOC(=O)N(C)C(=C[N+]#[C-])N(C)CC1=CC=CN1

Isomeric SMILES

CC(=O)OCOC(=O)N(C)/C(=C/[N+]#[C-])/N(C)CC1=CC=CN1

InChI

InChI=1S/C14H18N4O4/c1-11(19)21-10-22-14(20)18(4)13(8-15-2)17(3)9-12-6-5-7-16-12/h5-8,16H,9-10H2,1,3-4H3/b13-8+