3-methyl-4-(phenylcarbonyl)-4-azaspiro[4.5]dec-1-ene-3-carboxylic acid

Systemtic Name: 3-methyl-4-(phenylcarbonyl)-4-azaspiro[4.5]dec-1-ene-3-carboxylic acid Openeye Name: 4-benzoyl-3-methyl-4-azaspiro[4.5]dec-1-ene-3-carboxylic acid CAS Name: 4-benzoyl-3-methyl-4-azaspiro[4.5]dec-1-ene-3-carboxylic acid IUPAC Name: 4-benzoyl-3-methyl-4-azaspiro[4.5]dec-1-ene-3-carboxylic acid Traditional Name: 4-benzoyl-3-methyl-4-azaspiro[4.5]dec-1-ene-3-carboxylic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2(N1C(=O)C3=CC=CC=C3)CCCCC2)C(=O)O

Isomeric SMILES

CC1(C=CC2(N1C(=O)C3=CC=CC=C3)CCCCC2)C(=O)O

InChI

InChI=1S/C18H21NO3/c1-17(16(21)22)12-13-18(10-6-3-7-11-18)19(17)15(20)14-8-4-2-5-9-14/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H,21,22)