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

Systemtic Name: 2-(propylcarbamoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(propylcarbamoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[oxo(propylamino)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(propylcarbamoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-(propylcarbamoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CC2=CC=CC=C2CC1C(=O)O

Isomeric SMILES

CCCNC(=O)N1CC2=CC=CC=C2CC1C(=O)O

InChI

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