1-(4-aminophenyl)-2-(2-diethylaminoethyl)-1H-isoquinoline-4-carboxylic acid

Systemtic Name: 1-(4-aminophenyl)-2-(2-diethylaminoethyl)-1H-isoquinoline-4-carboxylic acid Openeye Name: 1-(4-aminophenyl)-2-(2-diethylaminoethyl)-1H-isoquinoline-4-carboxylic acid CAS Name: 1-(4-aminophenyl)-2-(2-diethylaminoethyl)-1H-isoquinoline-4-carboxylic acid IUPAC Name: 1-(4-aminophenyl)-2-(2-diethylaminoethyl)-1H-isoquinoline-4-carboxylic acid Traditional Name: 1-(4-aminophenyl)-2-(2-diethylaminoethyl)-1H-isoquinoline-4-carboxylic acid Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C=C(C2=CC=CC=C2C1C3=CC=C(C=C3)N)C(=O)O

Isomeric SMILES

CCN(CC)CCN1C=C(C2=CC=CC=C2C1C3=CC=C(C=C3)N)C(=O)O

InChI

InChI=1S/C22H27N3O2/c1-3-24(4-2)13-14-25-15-20(22(26)27)18-7-5-6-8-19(18)21(25)16-9-11-17(23)12-10-16/h5-12,15,21H,3-4,13-14,23H2,1-2H3,(H,26,27)