[3-nitro-4-(oxan-2-ylmethoxy)phenyl]methanamine

Systemtic Name: [3-nitro-4-(oxan-2-ylmethoxy)phenyl]methanamine Openeye Name: [3-nitro-4-(tetrahydropyran-2-ylmethoxy)phenyl]methanamine CAS Name: [3-nitro-4-(2-oxanylmethoxy)phenyl]methanamine IUPAC Name: [3-nitro-4-(oxan-2-ylmethoxy)phenyl]methanamine Traditional Name: [3-nitro-4-(tetrahydropyran-2-ylmethoxy)benzyl]amine Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)COC2=C(C=C(C=C2)CN)[N+](=O)[O-]

Isomeric SMILES

C1CCOC(C1)COC2=C(C=C(C=C2)CN)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O4/c14-8-10-4-5-13(12(7-10)15(16)17)19-9-11-3-1-2-6-18-11/h4-5,7,11H,1-3,6,8-9,14H2