1-(2-methylphenyl)carbonyl-8-(2-thiophen-2-ylethanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 1-(2-methylphenyl)carbonyl-8-(2-thiophen-2-ylethanoyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Openeye Name: 1-(2-methylbenzoyl)-8-[2-(2-thienyl)acetyl]-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid CAS Name: 1-[(2-methylphenyl)-oxomethyl]-8-(1-oxo-2-thiophen-2-ylethyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 1-(2-methylbenzoyl)-8-(2-thiophen-2-ylacetyl)-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Traditional Name: 1-o-toluoyl-8-[2-(2-thienyl)acetyl]-4-oxa-1,8-diazaspiro[4.5]decane-2-carboxylic acid Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2C(COC23CCN(CC3)C(=O)CC4=CC=CS4)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2C(COC23CCN(CC3)C(=O)CC4=CC=CS4)C(=O)O

InChI

InChI=1S/C22H24N2O5S/c1-15-5-2-3-7-17(15)20(26)24-18(21(27)28)14-29-22(24)8-10-23(11-9-22)19(25)13-16-6-4-12-30-16/h2-7,12,18H,8-11,13-14H2,1H3,(H,27,28)