2-[2-(aminocarbonylamino)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-[2-(aminocarbonylamino)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(2-ureidopropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[2-(carbamoylamino)-1-oxopropyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-[2-(carbamoylamino)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-(2-ureidopropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C14H17N3O4 MolecularWeight: 291.30248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4/c1-8(16-14(15)21)12(18)17-7-10-5-3-2-4-9(10)6-11(17)13(19)20/h2-5,8,11H,6-7H2,1H3,(H,19,20)(H3,15,16,21)