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

Systemtic Name: 1-(4-methoxyphenyl)carbonyl-8-(3-methylbutanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Openeye Name: 1-(4-methoxybenzoyl)-8-(3-methylbutanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)-oxomethyl]-8-(3-methyl-1-oxobutyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 1-(4-methoxybenzoyl)-8-(3-methylbutanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Traditional Name: 8-isovaleryl-1-p-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=C(C=C3)OC

Isomeric SMILES

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

InChI

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