pyridin-3-ylmethyl (2S)-2-[(1-azanylcyclopentyl)carbonylamino]-3-(4-methoxyphenyl)propanoate

Systemtic Name: pyridin-3-ylmethyl (2S)-2-[(1-azanylcyclopentyl)carbonylamino]-3-(4-methoxyphenyl)propanoate Openeye Name: 3-pyridylmethyl (2S)-2-[(1-aminocyclopentanecarbonyl)amino]-3-(4-methoxyphenyl)propanoate CAS Name: (2S)-2-[[(1-aminocyclopentyl)-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl (2S)-2-[(1-aminocyclopentanecarbonyl)amino]-3-(4-methoxyphenyl)propanoate Traditional Name: (2S)-2-[(1-aminocyclopentanecarbonyl)amino]-3-(4-methoxyphenyl)propionic acid 3-pyridylmethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)OCC2=CN=CC=C2)NC(=O)C3(CCCC3)N

Isomeric SMILES

COC1=CC=C(C=C1)C[C@@H](C(=O)OCC2=CN=CC=C2)NC(=O)C3(CCCC3)N

InChI

InChI=1S/C22H27N3O4/c1-28-18-8-6-16(7-9-18)13-19(25-21(27)22(23)10-2-3-11-22)20(26)29-15-17-5-4-12-24-14-17/h4-9,12,14,19H,2-3,10-11,13,15,23H2,1H3,(H,25,27)/t19-/m0/s1