ethyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-pyridin-3-yl-amino]ethanoate

Systemtic Name: ethyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-pyridin-3-yl-amino]ethanoate Openeye Name: ethyl 2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]-(3-pyridyl)amino]acetate CAS Name: 2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]-(3-pyridinyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-pyridin-3-ylamino]acetate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]-(3-pyridyl)amino]acetic acid ethyl ester Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N(CC(=O)OCC)C1=CN=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)N(CC(=O)OCC)C1=CN=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O5/c1-4-17(3)21(25-23(29)31-16-18-10-7-6-8-11-18)22(28)26(15-20(27)30-5-2)19-12-9-13-24-14-19/h6-14,17,21H,4-5,15-16H2,1-3H3,(H,25,29)