1-[4-[[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylamino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylamino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[[(2R)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylamino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[[(2R)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylamino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylamino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[[(2R)-5-ethoxy-2-methyl-coumaran-6-yl]methylamino]-3-nitro-phenyl]ethanone Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC3=C(C=C(C=C3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@H](O2)C)CNC3=C(C=C(C=C3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O5/c1-4-26-19-9-15-7-12(2)27-20(15)10-16(19)11-21-17-6-5-14(13(3)23)8-18(17)22(24)25/h5-6,8-10,12,21H,4,7,11H2,1-3H3/t12-/m1/s1