4-(isoquinolin-1-ylamino)pyrrolidine-1,2-dicarboxylic acid

Systemtic Name: 4-(isoquinolin-1-ylamino)pyrrolidine-1,2-dicarboxylic acid Openeye Name: 4-(1-isoquinolylamino)pyrrolidine-1,2-dicarboxylic acid CAS Name: 4-(1-isoquinolinylamino)pyrrolidine-1,2-dicarboxylic acid IUPAC Name: 4-(isoquinolin-1-ylamino)pyrrolidine-1,2-dicarboxylic acid Traditional Name: 4-(1-isoquinolylamino)pyrrolidine-1,2-dicarboxylic acid Formula: C15H15N3O4 MolecularWeight: 301.2973

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)O)NC2=NC=CC3=CC=CC=C32

Isomeric SMILES

C1C(CN(C1C(=O)O)C(=O)O)NC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C15H15N3O4/c19-14(20)12-7-10(8-18(12)15(21)22)17-13-11-4-2-1-3-9(11)5-6-16-13/h1-6,10,12H,7-8H2,(H,16,17)(H,19,20)(H,21,22)