4-methoxy-2-nitro-5-pentoxy-benzaldehyde

Systemtic Name: 4-methoxy-2-nitro-5-pentoxy-benzaldehyde Openeye Name: 4-methoxy-2-nitro-5-pentoxy-benzaldehyde CAS Name: 4-methoxy-2-nitro-5-pentoxybenzaldehyde IUPAC Name: 4-methoxy-2-nitro-5-pentoxybenzaldehyde Traditional Name: 5-amoxy-4-methoxy-2-nitro-benzaldehyde Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C(=C1)C=O)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCOC1=C(C=C(C(=C1)C=O)[N+](=O)[O-])OC

InChI

InChI=1S/C13H17NO5/c1-3-4-5-6-19-13-7-10(9-15)11(14(16)17)8-12(13)18-2/h7-9H,3-6H2,1-2H3