2-(3-azanylpyrrolidin-1-yl)-3-(1-phenylimidazol-4-yl)propanoic acid

Systemtic Name: 2-(3-azanylpyrrolidin-1-yl)-3-(1-phenylimidazol-4-yl)propanoic acid Openeye Name: 2-(3-aminopyrrolidin-1-yl)-3-(1-phenylimidazol-4-yl)propanoic acid CAS Name: 2-(3-amino-1-pyrrolidinyl)-3-(1-phenyl-4-imidazolyl)propanoic acid IUPAC Name: 2-(3-aminopyrrolidin-1-yl)-3-(1-phenylimidazol-4-yl)propanoic acid Traditional Name: 2-(3-aminopyrrolidino)-3-(1-phenylimidazol-4-yl)propionic acid Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C(CC2=CN(C=N2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CN(CC1N)C(CC2=CN(C=N2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H20N4O2/c17-12-6-7-19(9-12)15(16(21)22)8-13-10-20(11-18-13)14-4-2-1-3-5-14/h1-5,10-12,15H,6-9,17H2,(H,21,22)