2-(butoxycarbonylamino)-3-(4-nitrophenyl)propanoate

Systemtic Name: 2-(butoxycarbonylamino)-3-(4-nitrophenyl)propanoate Openeye Name: 2-(butoxycarbonylamino)-3-(4-nitrophenyl)propanoate CAS Name: 2-[[butoxy(oxo)methyl]amino]-3-(4-nitrophenyl)propanoate IUPAC Name: 2-(butoxycarbonylamino)-3-(4-nitrophenyl)propanoate Traditional Name: 2-(butoxycarbonylamino)-3-(4-nitrophenyl)propionate Formula: C14H17N2O6- MolecularWeight: 309.29458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCOC(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H18N2O6/c1-2-3-8-22-14(19)15-12(13(17)18)9-10-4-6-11(7-5-10)16(20)21/h4-7,12H,2-3,8-9H2,1H3,(H,15,19)(H,17,18)/p-1