[2,5-bis(oxidanylidene)pyrrolidin-3-yl] (2S)-2-(butoxycarbonylamino)-3-phenyl-propanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-3-yl] (2S)-2-(butoxycarbonylamino)-3-phenyl-propanoate Openeye Name: (2,5-dioxopyrrolidin-3-yl) (2S)-2-(butoxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[butoxy(oxo)methyl]amino]-3-phenylpropanoic acid (2,5-dioxo-3-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-3-yl) (2S)-2-(butoxycarbonylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(butoxycarbonylamino)-3-phenyl-propionic acid (2,5-diketopyrrolidin-3-yl) ester Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC1=CC=CC=C1)C(=O)OC2CC(=O)NC2=O

Isomeric SMILES

CCCCOC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC2CC(=O)NC2=O

InChI

InChI=1S/C18H22N2O6/c1-2-3-9-25-18(24)19-13(10-12-7-5-4-6-8-12)17(23)26-14-11-15(21)20-16(14)22/h4-8,13-14H,2-3,9-11H2,1H3,(H,19,24)(H,20,21,22)/t13-,14?/m0/s1