1-(2-dimethylaminoethylamino)isoquinoline-3-carboxylic acid

Systemtic Name: 1-(2-dimethylaminoethylamino)isoquinoline-3-carboxylic acid Openeye Name: 1-(2-dimethylaminoethylamino)isoquinoline-3-carboxylic acid CAS Name: 1-(2-dimethylaminoethylamino)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(2-dimethylaminoethylamino)isoquinoline-3-carboxylic acid Traditional Name: 1-(2-dimethylaminoethylamino)isoquinoline-3-carboxylic acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=NC(=CC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CN(C)CCNC1=NC(=CC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H17N3O2/c1-17(2)8-7-15-13-11-6-4-3-5-10(11)9-12(16-13)14(18)19/h3-6,9H,7-8H2,1-2H3,(H,15,16)(H,18,19)