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

Systemtic Name: 9-(4-carbamimidoylphenyl)carbonyl-9-azaspiro[5.5]undecane-3-carboxylic acid Openeye Name: 9-(4-carbamimidoylbenzoyl)-9-azaspiro[5.5]undecane-3-carboxylic acid CAS Name: 9-[(4-carbamimidoylphenyl)-oxomethyl]-9-azaspiro[5.5]undecane-3-carboxylic acid IUPAC Name: 9-(4-carbamimidoylbenzoyl)-9-azaspiro[5.5]undecane-3-carboxylic acid Traditional Name: 9-(4-amidinobenzoyl)-9-azaspiro[5.5]undecane-3-carboxylic acid Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1C(=O)O)CCN(CC2)C(=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CC2(CCC1C(=O)O)CCN(CC2)C(=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H25N3O3/c20-16(21)13-1-3-14(4-2-13)17(23)22-11-9-19(10-12-22)7-5-15(6-8-19)18(24)25/h1-4,15H,5-12H2,(H3,20,21)(H,24,25)