methyl 3-[1-(3-methylbutyl)imidazol-4-yl]-2-[3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]propanoate

Systemtic Name: methyl 3-[1-(3-methylbutyl)imidazol-4-yl]-2-[3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]propanoate Openeye Name: methyl 2-[3-(benzyloxycarbonylamino)pyrrolidin-1-yl]-3-(1-isopentylimidazol-4-yl)propanoate CAS Name: 3-[1-(3-methylbutyl)-4-imidazolyl]-2-[3-(phenylmethoxycarbonylamino)-1-pyrrolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(3-methylbutyl)imidazol-4-yl]-2-[3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]propanoate Traditional Name: 2-[3-(benzyloxycarbonylamino)pyrrolidino]-3-(1-isoamylimidazol-4-yl)propionic acid methyl ester Formula: C24H34N4O4 MolecularWeight: 442.55116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(N=C1)CC(C(=O)OC)N2CCC(C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN1C=C(N=C1)CC(C(=O)OC)N2CCC(C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H34N4O4/c1-18(2)9-11-27-14-21(25-17-27)13-22(23(29)31-3)28-12-10-20(15-28)26-24(30)32-16-19-7-5-4-6-8-19/h4-8,14,17-18,20,22H,9-13,15-16H2,1-3H3,(H,26,30)