2-[[(2S)-2-methylpyrrolidin-2-yl]carbonylamino]-3-[1-(phenylmethyl)imidazol-4-yl]propanoic acid

Systemtic Name: 2-[[(2S)-2-methylpyrrolidin-2-yl]carbonylamino]-3-[1-(phenylmethyl)imidazol-4-yl]propanoic acid Openeye Name: 3-(1-benzylimidazol-4-yl)-2-[[(2S)-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid CAS Name: 2-[[[(2S)-2-methyl-2-pyrrolidinyl]-oxomethyl]amino]-3-[1-(phenylmethyl)-4-imidazolyl]propanoic acid IUPAC Name: 3-(1-benzylimidazol-4-yl)-2-[[(2S)-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(1-benzylimidazol-4-yl)-2-[[(2S)-2-methylprolyl]amino]propionic acid Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN1)C(=O)NC(CC2=CN(C=N2)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C[C@]1(CCCN1)C(=O)NC(CC2=CN(C=N2)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H24N4O3/c1-19(8-5-9-21-19)18(26)22-16(17(24)25)10-15-12-23(13-20-15)11-14-6-3-2-4-7-14/h2-4,6-7,12-13,16,21H,5,8-11H2,1H3,(H,22,26)(H,24,25)/t16?,19-/m0/s1