[4-(cyclopropylmethoxy)-5-methoxy-2-nitro-phenyl]methanamine

Systemtic Name: [4-(cyclopropylmethoxy)-5-methoxy-2-nitro-phenyl]methanamine Openeye Name: [4-(cyclopropylmethoxy)-5-methoxy-2-nitro-phenyl]methanamine CAS Name: [4-(cyclopropylmethoxy)-5-methoxy-2-nitrophenyl]methanamine IUPAC Name: [4-(cyclopropylmethoxy)-5-methoxy-2-nitrophenyl]methanamine Traditional Name: [4-(cyclopropylmethoxy)-5-methoxy-2-nitro-benzyl]amine Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN)[N+](=O)[O-])OCC2CC2

Isomeric SMILES

COC1=C(C=C(C(=C1)CN)[N+](=O)[O-])OCC2CC2

InChI

InChI=1S/C12H16N2O4/c1-17-11-4-9(6-13)10(14(15)16)5-12(11)18-7-8-2-3-8/h4-5,8H,2-3,6-7,13H2,1H3