4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]amino]butanoic acid

Systemtic Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]amino]butanoic acid Openeye Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]amino]butanoic acid CAS Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]amino]butanoic acid Traditional Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]amino]butyric acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CNCCCC(=O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CNCCCC(=O)O

InChI

InChI=1S/C15H20N2O3/c18-14(10-16-8-3-6-15(19)20)17-9-7-12-4-1-2-5-13(12)11-17/h1-2,4-5,16H,3,6-11H2,(H,19,20)