4-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]butanoic acid

Systemtic Name: 4-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]butanoic acid Openeye Name: 4-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]butanoic acid CAS Name: 4-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]butanoic acid IUPAC Name: 4-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]butanoic acid Traditional Name: 4-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]butyric acid Formula: C15H20N2O2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=N1)NCCCC(=O)O)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=N1)NCCCC(=O)O)C

InChI

InChI=1S/C15H20N2O2/c1-15(2)10-11-6-3-4-7-12(11)14(17-15)16-9-5-8-13(18)19/h3-4,6-7H,5,8-10H2,1-2H3,(H,16,17)(H,18,19)