2-methylpropyl 2-azanyl-3-[4-[2-azanyl-3-(2-methylpropoxy)-3-oxidanylidene-propyl]phenyl]propanoate dihydrochloride

Systemtic Name: 2-methylpropyl 2-azanyl-3-[4-[2-azanyl-3-(2-methylpropoxy)-3-oxidanylidene-propyl]phenyl]propanoate dihydrochloride Openeye Name: isobutyl 2-amino-3-[4-(2-amino-3-isobutoxy-3-oxo-propyl)phenyl]propanoate dihydrochloride CAS Name: 2-amino-3-[4-[2-amino-3-(2-methylpropoxy)-3-oxopropyl]phenyl]propanoic acid 2-methylpropyl ester dihydrochloride IUPAC Name: 2-methylpropyl 2-amino-3-[4-[2-amino-3-(2-methylpropoxy)-3-oxopropyl]phenyl]propanoate dihydrochloride Traditional Name: 2-amino-3-[4-(2-amino-3-isobutoxy-3-keto-propyl)phenyl]propionic acid isobutyl ester dihydrochloride Formula: C20H34Cl2N2O4 MolecularWeight: 437.40096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(CC1=CC=C(C=C1)CC(C(=O)OCC(C)C)N)N.Cl.Cl

Isomeric SMILES

CC(C)COC(=O)C(CC1=CC=C(C=C1)CC(C(=O)OCC(C)C)N)N.Cl.Cl

InChI

InChI=1S/C20H32N2O4.2ClH/c1-13(2)11-25-19(23)17(21)9-15-5-7-16(8-6-15)10-18(22)20(24)26-12-14(3)4;;/h5-8,13-14,17-18H,9-12,21-22H2,1-4H3;2*1H