8-[4-(1-azanylethyl)phenyl]-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 8-[4-(1-azanylethyl)phenyl]-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-[4-(1-aminoethyl)phenyl]-1-cyclopropyl-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-[4-(1-aminoethyl)phenyl]-1-cyclopropyl-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-[4-(1-aminoethyl)phenyl]-1-cyclopropyl-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-[4-(1-aminoethyl)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=C(C=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)C4=CC=C(C=C4)C(C)N

Isomeric SMILES

CC1=C(C=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)C4=CC=C(C=C4)C(C)N

InChI

InChI=1S/C22H22N2O3/c1-12-17(15-5-3-14(4-6-15)13(2)23)9-10-24-20(12)18(16-7-8-16)11-19(21(24)25)22(26)27/h3-6,9-11,13,16H,7-8,23H2,1-2H3,(H,26,27)