2-(2-diethylaminoethyl)-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(2-diethylaminoethyl)-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylic acid Openeye Name: 2-(2-diethylaminoethyl)-1-oxo-4-phenyl-isoquinoline-3-carboxylic acid CAS Name: 2-(2-diethylaminoethyl)-1-oxo-4-phenyl-3-isoquinolinecarboxylic acid IUPAC Name: 2-(2-diethylaminoethyl)-1-oxo-4-phenylisoquinoline-3-carboxylic acid Traditional Name: 2-(2-diethylaminoethyl)-1-keto-4-phenyl-isoquinoline-3-carboxylic acid Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCN(CC)CCN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H24N2O3/c1-3-23(4-2)14-15-24-20(22(26)27)19(16-10-6-5-7-11-16)17-12-8-9-13-18(17)21(24)25/h5-13H,3-4,14-15H2,1-2H3,(H,26,27)