(phenylmethyl) 2-(2,3-dihydro-1H-isoindol-1-ylamino)-3-(2-methanoyl-1H-imidazol-5-yl)propanoate

Systemtic Name: (phenylmethyl) 2-(2,3-dihydro-1H-isoindol-1-ylamino)-3-(2-methanoyl-1H-imidazol-5-yl)propanoate Openeye Name: benzyl 3-(2-formyl-1H-imidazol-5-yl)-2-(isoindolin-1-ylamino)propanoate CAS Name: 2-(2,3-dihydro-1H-isoindol-1-ylamino)-3-(2-formyl-1H-imidazol-5-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2,3-dihydro-1H-isoindol-1-ylamino)-3-(2-formyl-1H-imidazol-5-yl)propanoate Traditional Name: 3-(2-formyl-1H-imidazol-5-yl)-2-(isoindolin-1-ylamino)propionic acid benzyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(N1)NC(CC3=CN=C(N3)C=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2C(N1)NC(CC3=CN=C(N3)C=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O3/c27-13-20-23-12-17(25-20)10-19(22(28)29-14-15-6-2-1-3-7-15)26-21-18-9-5-4-8-16(18)11-24-21/h1-9,12-13,19,21,24,26H,10-11,14H2,(H,23,25)