(phenylmethyl) 3-(2-methanoyl-1H-imidazol-5-yl)-2-(1,2,3,4-tetrahydroisoquinolin-1-ylamino)propanoate

Systemtic Name: (phenylmethyl) 3-(2-methanoyl-1H-imidazol-5-yl)-2-(1,2,3,4-tetrahydroisoquinolin-1-ylamino)propanoate Openeye Name: benzyl 3-(2-formyl-1H-imidazol-5-yl)-2-(1,2,3,4-tetrahydroisoquinolin-1-ylamino)propanoate CAS Name: 3-(2-formyl-1H-imidazol-5-yl)-2-(1,2,3,4-tetrahydroisoquinolin-1-ylamino)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(2-formyl-1H-imidazol-5-yl)-2-(1,2,3,4-tetrahydroisoquinolin-1-ylamino)propanoate Traditional Name: 3-(2-formyl-1H-imidazol-5-yl)-2-(1,2,3,4-tetrahydroisoquinolin-1-ylamino)propionic acid benzyl ester Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC=CC=C21)NC(CC3=CN=C(N3)C=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CNC(C2=CC=CC=C21)NC(CC3=CN=C(N3)C=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O3/c28-14-21-25-13-18(26-21)12-20(23(29)30-15-16-6-2-1-3-7-16)27-22-19-9-5-4-8-17(19)10-11-24-22/h1-9,13-14,20,22,24,27H,10-12,15H2,(H,25,26)