1-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 1-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 1-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 1-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 1-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 1-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC=CC=C1C2C3=CC=CC=C3CCN2C(=O)O

Isomeric SMILES

CNC(=O)NC1=CC=CC=C1C2C3=CC=CC=C3CCN2C(=O)O

InChI

InChI=1S/C18H19N3O3/c1-19-17(22)20-15-9-5-4-8-14(15)16-13-7-3-2-6-12(13)10-11-21(16)18(23)24/h2-9,16H,10-11H2,1H3,(H,23,24)(H2,19,20,22)