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

Systemtic Name: 3-ethanoyl-2,7,7-trimethyl-4-(4-nitrophenyl)-1,4,6,8-tetrahydroquinolin-5-one Openeye Name: 3-acetyl-2,7,7-trimethyl-4-(4-nitrophenyl)-1,4,6,8-tetrahydroquinolin-5-one CAS Name: 3-acetyl-2,7,7-trimethyl-4-(4-nitrophenyl)-1,4,6,8-tetrahydroquinolin-5-one IUPAC Name: 3-acetyl-2,7,7-trimethyl-4-(4-nitrophenyl)-1,4,6,8-tetrahydroquinolin-5-one Traditional Name: 3-acetyl-2,7,7-trimethyl-4-(4-nitrophenyl)-1,4,6,8-tetrahydroquinolin-5-one Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C20H22N2O4/c1-11-17(12(2)23)18(13-5-7-14(8-6-13)22(25)26)19-15(21-11)9-20(3,4)10-16(19)24/h5-8,18,21H,9-10H2,1-4H3