1-(3-methoxyphenyl)carbonyl-8-(3-methylbutanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 1-(3-methoxyphenyl)carbonyl-8-(3-methylbutanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Openeye Name: 1-(3-methoxybenzoyl)-8-(3-methylbutanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)-oxomethyl]-8-(3-methyl-1-oxobutyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 1-(3-methoxybenzoyl)-8-(3-methylbutanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Traditional Name: 8-isovaleryl-1-m-anisoyl-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2(CC1)N(C(CO2)C(=O)O)C(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CC(=O)N1CCC2(CC1)N(C(CO2)C(=O)O)C(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H28N2O6/c1-14(2)11-18(24)22-9-7-21(8-10-22)23(17(13-29-21)20(26)27)19(25)15-5-4-6-16(12-15)28-3/h4-6,12,14,17H,7-11,13H2,1-3H3,(H,26,27)