(2S,4R)-1-(5,6-dihydrobenzo[h]quinazolin-4-yl)-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4R)-1-(5,6-dihydrobenzo[h]quinazolin-4-yl)-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4R)-1-(5,6-dihydrobenzo[h]quinazolin-4-yl)-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: (2S,4R)-1-(5,6-dihydrobenzo[h]quinazolin-4-yl)-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4R)-1-(5,6-dihydrobenzo[h]quinazolin-4-yl)-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: (2S,4R)-1-(5,6-dihydrobenzo[h]quinazolin-4-yl)-4-hydroxy-proline Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)N=CN=C2N4CC(CC4C(=O)O)O

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)N=CN=C2N4C[C@@H](C[C@H]4C(=O)O)O

InChI

InChI=1S/C17H17N3O3/c21-11-7-14(17(22)23)20(8-11)16-13-6-5-10-3-1-2-4-12(10)15(13)18-9-19-16/h1-4,9,11,14,21H,5-8H2,(H,22,23)/t11-,14+/m1/s1