6-[(2-tert-butyl-3H-benzimidazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(2-tert-butyl-3H-benzimidazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(2-tert-butyl-3H-benzimidazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[(2-tert-butyl-3H-benzimidazol-5-yl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(2-tert-butyl-3H-benzimidazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(2-tert-butyl-3H-benzimidazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1)C=C(C=C2)NC(=O)C3CC=CCC3C(=O)O

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1)C=C(C=C2)NC(=O)C3CC=CCC3C(=O)O

InChI

InChI=1S/C19H23N3O3/c1-19(2,3)18-21-14-9-8-11(10-15(14)22-18)20-16(23)12-6-4-5-7-13(12)17(24)25/h4-5,8-10,12-13H,6-7H2,1-3H3,(H,20,23)(H,21,22)(H,24,25)