(E)-but-2-enedioic acid; 3,8-dimethyl-3-phenyl-4-oxa-8-azaspiro[4.5]decan-1-one

Systemtic Name: (E)-but-2-enedioic acid; 3,8-dimethyl-3-phenyl-4-oxa-8-azaspiro[4.5]decan-1-one Openeye Name: 3,8-dimethyl-3-phenyl-4-oxa-8-azaspiro[4.5]decan-1-one; fumaric acid CAS Name: (E)-2-butenedioic acid; 3,8-dimethyl-3-phenyl-4-oxa-8-azaspiro[4.5]decan-1-one IUPAC Name: (E)-but-2-enedioic acid; 3,8-dimethyl-3-phenyl-4-oxa-8-azaspiro[4.5]decan-1-one Traditional Name: 3,8-dimethyl-3-phenyl-4-oxa-8-azaspiro[4.5]decan-1-one; fumaric acid Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2(O1)CCN(CC2)C)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1(CC(=O)C2(O1)CCN(CC2)C)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C16H21NO2.C4H4O4/c1-15(13-6-4-3-5-7-13)12-14(18)16(19-15)8-10-17(2)11-9-16;5-3(6)1-2-4(7)8/h3-7H,8-12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+