methyl N-[6-[[(E)-4-oxidanylbut-2-enyl]carbamoyl]-1H-benzimidazol-2-yl]carbamate

Systemtic Name: methyl N-[6-[[(E)-4-oxidanylbut-2-enyl]carbamoyl]-1H-benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-[[(E)-4-hydroxybut-2-enyl]carbamoyl]-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[[[(E)-4-hydroxybut-2-enyl]amino]-oxomethyl]-1H-benzimidazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[6-[[(E)-4-hydroxybut-2-enyl]carbamoyl]-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[[(E)-4-hydroxybut-2-enyl]carbamoyl]-1H-benzimidazol-2-yl]carbamic acid methyl ester Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)NCC=CCO

Isomeric SMILES

COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)NC/C=C/CO

InChI

InChI=1S/C14H16N4O4/c1-22-14(21)18-13-16-10-5-4-9(8-11(10)17-13)12(20)15-6-2-3-7-19/h2-5,8,19H,6-7H2,1H3,(H,15,20)(H2,16,17,18,21)/b3-2+