9-(4-isocyanophenyl)carbonyl-9-azaspiro[5.5]undecane-3-carboxylic acid

Systemtic Name: 9-(4-isocyanophenyl)carbonyl-9-azaspiro[5.5]undecane-3-carboxylic acid Openeye Name: 9-(4-isocyanobenzoyl)-9-azaspiro[5.5]undecane-3-carboxylic acid CAS Name: 9-[(4-isocyanophenyl)-oxomethyl]-9-azaspiro[5.5]undecane-3-carboxylic acid IUPAC Name: 9-(4-isocyanobenzoyl)-9-azaspiro[5.5]undecane-3-carboxylic acid Traditional Name: 9-(4-isocyanobenzoyl)-9-azaspiro[5.5]undecane-3-carboxylic acid Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=C(C=C1)C(=O)N2CCC3(CCC(CC3)C(=O)O)CC2

Isomeric SMILES

[C-]#[N+]C1=CC=C(C=C1)C(=O)N2CCC3(CCC(CC3)C(=O)O)CC2

InChI

InChI=1S/C19H22N2O3/c1-20-16-4-2-14(3-5-16)17(22)21-12-10-19(11-13-21)8-6-15(7-9-19)18(23)24/h2-5,15H,6-13H2,(H,23,24)