1,3-benzodioxol-5-yl 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: 1,3-benzodioxol-5-yl 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid 1,3-benzodioxol-5-yl ester Formula: C17H14N2O7 MolecularWeight: 358.30226

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O7/c20-16(26-13-5-6-14-15(9-13)25-10-24-14)7-8-18-17(21)11-1-3-12(4-2-11)19(22)23/h1-6,9H,7-8,10H2,(H,18,21)