4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzaldehyde

Systemtic Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzaldehyde Openeye Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzaldehyde CAS Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitrobenzaldehyde IUPAC Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitrobenzaldehyde Traditional Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzaldehyde Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCCO2)NC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-11(13-3-5-16-17(9-13)24-7-6-23-16)18-14-4-2-12(10-20)8-15(14)19(21)22/h2-5,8-11,18H,6-7H2,1H3/t11-/m1/s1