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

Systemtic Name: 8-[3-(aminomethyl)phenyl]-1-cyclopropyl-9-methoxy-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-[3-(aminomethyl)phenyl]-1-cyclopropyl-9-methoxy-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-[3-(aminomethyl)phenyl]-1-cyclopropyl-9-methoxy-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-[3-(aminomethyl)phenyl]-1-cyclopropyl-9-methoxy-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-[3-(aminomethyl)phenyl]-1-cyclopropyl-4-keto-9-methoxy-quinolizine-3-carboxylic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)C4=CC(=CC=C4)CN

Isomeric SMILES

COC1=C(C=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)C4=CC(=CC=C4)CN

InChI

InChI=1S/C21H20N2O4/c1-27-19-15(14-4-2-3-12(9-14)11-22)7-8-23-18(19)16(13-5-6-13)10-17(20(23)24)21(25)26/h2-4,7-10,13H,5-6,11,22H2,1H3,(H,25,26)