4-(3-oxidanylidene-5,7a-dihydro-1H-pyrrolo[1,2-c]imidazol-2-yl)adamantane-1-carboxylic acid

Systemtic Name: 4-(3-oxidanylidene-5,7a-dihydro-1H-pyrrolo[1,2-c]imidazol-2-yl)adamantane-1-carboxylic acid Openeye Name: 4-(3-oxo-5,7a-dihydro-1H-pyrrolo[1,2-c]imidazol-2-yl)adamantane-1-carboxylic acid CAS Name: 4-(3-oxo-5,7a-dihydro-1H-pyrrolo[1,2-c]imidazol-2-yl)-1-adamantanecarboxylic acid IUPAC Name: 4-(3-oxo-5,7a-dihydro-1H-pyrrolo[1,2-c]imidazol-2-yl)adamantane-1-carboxylic acid Traditional Name: 4-(3-keto-5,7a-dihydro-1H-pyrrol[1,2-c]imidazol-2-yl)adamantane-1-carboxylic acid Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2N1C(=O)N(C2)C3C4CC5CC3CC(C5)(C4)C(=O)O

Isomeric SMILES

C1C=CC2N1C(=O)N(C2)C3C4CC5CC3CC(C5)(C4)C(=O)O

InChI

InChI=1S/C17H22N2O3/c20-15(21)17-6-10-4-11(7-17)14(12(5-10)8-17)19-9-13-2-1-3-18(13)16(19)22/h1-2,10-14H,3-9H2,(H,20,21)