1-(1-adamantyl)-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-(1-adamantyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-(1-adamantyl)-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-(1-adamantyl)-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-(1-adamantyl)-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-(1-adamantyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C23CC4CC(C2)CC(C4)C3)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C23CC4CC(C2)CC(C4)C3)C)C(=O)O

InChI

InChI=1S/C17H23NO2/c1-10-3-15(16(19)20)11(2)18(10)17-7-12-4-13(8-17)6-14(5-12)9-17/h3,12-14H,4-9H2,1-2H3,(H,19,20)