4-(1,3-benzodioxol-5-yl)-3-ethanoyl-2,6,6-trimethyl-1,4,7,8-tetrahydroquinolin-5-one

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-3-ethanoyl-2,6,6-trimethyl-1,4,7,8-tetrahydroquinolin-5-one Openeye Name: 3-acetyl-4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-1,4,7,8-tetrahydroquinolin-5-one CAS Name: 3-acetyl-4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-1,4,7,8-tetrahydroquinolin-5-one IUPAC Name: 3-acetyl-4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-1,4,7,8-tetrahydroquinolin-5-one Traditional Name: 3-acetyl-4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-1,4,7,8-tetrahydroquinolin-5-one Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CCC(C2=O)(C)C)C3=CC4=C(C=C3)OCO4)C(=O)C

Isomeric SMILES

CC1=C(C(C2=C(N1)CCC(C2=O)(C)C)C3=CC4=C(C=C3)OCO4)C(=O)C

InChI

InChI=1S/C21H23NO4/c1-11-17(12(2)23)18(13-5-6-15-16(9-13)26-10-25-15)19-14(22-11)7-8-21(3,4)20(19)24/h5-6,9,18,22H,7-8,10H2,1-4H3