2-[(2-methylpropan-2-yl)oxycarbonyl-propyl-amino]-4-(1-propylbenzimidazol-2-yl)butanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-propyl-amino]-4-(1-propylbenzimidazol-2-yl)butanoic acid Openeye Name: 2-[tert-butoxycarbonyl(propyl)amino]-4-(1-propylbenzimidazol-2-yl)butanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-propylamino]-4-(1-propyl-2-benzimidazolyl)butanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-propylamino]-4-(1-propylbenzimidazol-2-yl)butanoic acid Traditional Name: 2-[tert-butoxycarbonyl(propyl)amino]-4-(1-propylbenzimidazol-2-yl)butyric acid Formula: C22H33N3O4 MolecularWeight: 403.51512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1CCC(C(=O)O)N(CCC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1CCC(C(=O)O)N(CCC)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33N3O4/c1-6-14-24-17-11-9-8-10-16(17)23-19(24)13-12-18(20(26)27)25(15-7-2)21(28)29-22(3,4)5/h8-11,18H,6-7,12-15H2,1-5H3,(H,26,27)