(2R,5R)-2-(2-methylpropoxymethyl)-8-phenylazanyl-3-oxa-9-thia-7-azaspiro[4.4]non-7-ene-4,6-dione

Systemtic Name: (2R,5R)-2-(2-methylpropoxymethyl)-8-phenylazanyl-3-oxa-9-thia-7-azaspiro[4.4]non-7-ene-4,6-dione Openeye Name: (2R,5R)-8-anilino-2-(isobutoxymethyl)-3-oxa-9-thia-7-azaspiro[4.4]non-7-ene-4,6-dione CAS Name: (2R,5R)-8-anilino-2-(2-methylpropoxymethyl)-3-oxa-9-thia-7-azaspiro[4.4]non-7-ene-4,6-dione IUPAC Name: (2R,5R)-8-anilino-2-(2-methylpropoxymethyl)-3-oxa-9-thia-7-azaspiro[4.4]non-7-ene-4,6-dione Traditional Name: (2R,5R)-8-anilino-2-(isobutoxymethyl)-3-oxa-9-thia-7-azaspiro[4.4]non-7-ene-4,6-quinone Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC1CC2(C(=O)N=C(S2)NC3=CC=CC=C3)C(=O)O1

Isomeric SMILES

CC(C)COC[C@H]1C[C@@]2(C(=O)N=C(S2)NC3=CC=CC=C3)C(=O)O1

InChI

InChI=1S/C17H20N2O4S/c1-11(2)9-22-10-13-8-17(15(21)23-13)14(20)19-16(24-17)18-12-6-4-3-5-7-12/h3-7,11,13H,8-10H2,1-2H3,(H,18,19,20)/t13-,17-/m1/s1