2-[3-[(tert-butylamino)methyl]phenyl]-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 2-[3-[(tert-butylamino)methyl]phenyl]-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 2-[3-[(tert-butylamino)methyl]phenyl]-1-cyclopropyl-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 2-[3-[(tert-butylamino)methyl]phenyl]-1-cyclopropyl-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 2-[3-[(tert-butylamino)methyl]phenyl]-1-cyclopropyl-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 2-[3-[(tert-butylamino)methyl]phenyl]-1-cyclopropyl-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=C(C(=C(C2=O)C(=O)O)C3=CC(=CC=C3)CNC(C)(C)C)C4CC4

Isomeric SMILES

CC1=CC=CN2C1=C(C(=C(C2=O)C(=O)O)C3=CC(=CC=C3)CNC(C)(C)C)C4CC4

InChI

InChI=1S/C25H28N2O3/c1-15-7-6-12-27-22(15)20(17-10-11-17)19(21(23(27)28)24(29)30)18-9-5-8-16(13-18)14-26-25(2,3)4/h5-9,12-13,17,26H,10-11,14H2,1-4H3,(H,29,30)