3-[cyclohexylmethyl(1H-1,2,4-triazol-5-ylmethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 3-[cyclohexylmethyl(1H-1,2,4-triazol-5-ylmethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 3-[cyclohexylmethyl(1H-1,2,4-triazol-5-ylmethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 3-[cyclohexylmethyl(1H-1,2,4-triazol-5-ylmethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 3-[cyclohexylmethyl(1H-1,2,4-triazol-5-ylmethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 3-[cyclohexylmethyl(1H-1,2,4-triazol-5-ylmethyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C16H24N6O2 MolecularWeight: 332.40076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CC2=NC=NN2)C(CC(=O)O)C3=CN=CN3

Isomeric SMILES

C1CCC(CC1)CN(CC2=NC=NN2)C(CC(=O)O)C3=CN=CN3

InChI

InChI=1S/C16H24N6O2/c23-16(24)6-14(13-7-17-10-18-13)22(9-15-19-11-20-21-15)8-12-4-2-1-3-5-12/h7,10-12,14H,1-6,8-9H2,(H,17,18)(H,23,24)(H,19,20,21)