methyl 1-(phenylmethyl)-4,5,6,7-tetrahydrobenzimidazole-2-carboxylate

Systemtic Name: methyl 1-(phenylmethyl)-4,5,6,7-tetrahydrobenzimidazole-2-carboxylate Openeye Name: methyl 1-benzyl-4,5,6,7-tetrahydrobenzimidazole-2-carboxylate CAS Name: 1-(phenylmethyl)-4,5,6,7-tetrahydrobenzimidazole-2-carboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-4,5,6,7-tetrahydrobenzimidazole-2-carboxylate Traditional Name: 1-benzyl-4,5,6,7-tetrahydrobenzimidazole-2-carboxylic acid methyl ester Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=C(N1CC3=CC=CC=C3)CCCC2

Isomeric SMILES

COC(=O)C1=NC2=C(N1CC3=CC=CC=C3)CCCC2

InChI

InChI=1S/C16H18N2O2/c1-20-16(19)15-17-13-9-5-6-10-14(13)18(15)11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3