2-dimethylaminoethyl-(5-nitro-2,3-dihydro-1-benzofuran-7-yl)carbamic acid

Systemtic Name: 2-dimethylaminoethyl-(5-nitro-2,3-dihydro-1-benzofuran-7-yl)carbamic acid Openeye Name: 2-dimethylaminoethyl-(5-nitro-2,3-dihydrobenzofuran-7-yl)carbamic acid CAS Name: 2-dimethylaminoethyl-(5-nitro-2,3-dihydrobenzofuran-7-yl)carbamic acid IUPAC Name: 2-dimethylaminoethyl-(5-nitro-2,3-dihydro-1-benzofuran-7-yl)carbamic acid Traditional Name: 2-dimethylaminoethyl-(5-nitrocoumaran-7-yl)carbamic acid Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=C2C(=CC(=C1)[N+](=O)[O-])CCO2)C(=O)O

Isomeric SMILES

CN(C)CCN(C1=C2C(=CC(=C1)[N+](=O)[O-])CCO2)C(=O)O

InChI

InChI=1S/C13H17N3O5/c1-14(2)4-5-15(13(17)18)11-8-10(16(19)20)7-9-3-6-21-12(9)11/h7-8H,3-6H2,1-2H3,(H,17,18)