4-(1-cyclohexyl-3-ethyl-indazol-6-yl)-4-isocyano-cyclohexane-1-carboxylic acid

Systemtic Name: 4-(1-cyclohexyl-3-ethyl-indazol-6-yl)-4-isocyano-cyclohexane-1-carboxylic acid Openeye Name: 4-(1-cyclohexyl-3-ethyl-indazol-6-yl)-4-isocyano-cyclohexanecarboxylic acid CAS Name: 4-(1-cyclohexyl-3-ethyl-6-indazolyl)-4-isocyano-1-cyclohexanecarboxylic acid IUPAC Name: 4-(1-cyclohexyl-3-ethylindazol-6-yl)-4-isocyanocyclohexane-1-carboxylic acid Traditional Name: 4-(1-cyclohexyl-3-ethyl-indazol-6-yl)-4-isocyano-cyclohexanecarboxylic acid Formula: C23H29N3O2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(=O)O)[N+]#[C-])C4CCCCC4

Isomeric SMILES

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(=O)O)[N+]#[C-])C4CCCCC4

InChI

InChI=1S/C23H29N3O2/c1-3-20-19-10-9-17(23(24-2)13-11-16(12-14-23)22(27)28)15-21(19)26(25-20)18-7-5-4-6-8-18/h9-10,15-16,18H,3-8,11-14H2,1H3,(H,27,28)