8-(4-azanyl-3,5-dimethyl-phenyl)-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 8-(4-azanyl-3,5-dimethyl-phenyl)-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-(4-amino-3,5-dimethyl-phenyl)-1-cyclopropyl-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-(4-amino-3,5-dimethylphenyl)-1-cyclopropyl-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-(4-amino-3,5-dimethylphenyl)-1-cyclopropyl-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-(4-amino-3,5-dimethyl-phenyl)-1-cyclopropyl-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N)C)C2=C(C3=C(C=C(C(=O)N3C=C2)C(=O)O)C4CC4)C

Isomeric SMILES

CC1=CC(=CC(=C1N)C)C2=C(C3=C(C=C(C(=O)N3C=C2)C(=O)O)C4CC4)C

InChI

InChI=1S/C22H22N2O3/c1-11-8-15(9-12(2)19(11)23)16-6-7-24-20(13(16)3)17(14-4-5-14)10-18(21(24)25)22(26)27/h6-10,14H,4-5,23H2,1-3H3,(H,26,27)