2-(2-azanylbutanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(2-azanylbutanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(2-aminobutanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-(2-amino-1-oxobutyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(2-aminobutanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-(2-aminobutanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CC2=CC=CC=C2CC1C(=O)O)N

Isomeric SMILES

CCC(C(=O)N1CC2=CC=CC=C2CC1C(=O)O)N

InChI

InChI=1S/C14H18N2O3/c1-2-11(15)13(17)16-8-10-6-4-3-5-9(10)7-12(16)14(18)19/h3-6,11-12H,2,7-8,15H2,1H3,(H,18,19)