propan-2-yloxycarbonyloxymethyl 2-(3-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: propan-2-yloxycarbonyloxymethyl 2-(3-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoate Openeye Name: isopropoxycarbonyloxymethyl 2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoate CAS Name: 2-[(3-amino-1-oxopropyl)amino]-3-(1H-imidazol-5-yl)propanoic acid [oxo(propan-2-yloxy)methoxy]methyl ester IUPAC Name: propan-2-yloxycarbonyloxymethyl 2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoate Traditional Name: 2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propionic acid isopropoxycarbonyloxymethyl ester Formula: C14H22N4O6 MolecularWeight: 342.34768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)OCOC(=O)C(CC1=CN=CN1)NC(=O)CCN

Isomeric SMILES

CC(C)OC(=O)OCOC(=O)C(CC1=CN=CN1)NC(=O)CCN

InChI

InChI=1S/C14H22N4O6/c1-9(2)24-14(21)23-8-22-13(20)11(18-12(19)3-4-15)5-10-6-16-7-17-10/h6-7,9,11H,3-5,8,15H2,1-2H3,(H,16,17)(H,18,19)