N-[(3,4-dimethoxyphenyl)methyl]-3-(4-nitrophenoxy)propan-1-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-nitrophenoxy)propan-1-amine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-nitrophenoxy)propan-1-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-nitrophenoxy)-1-propanamine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-nitrophenoxy)propan-1-amine Traditional Name: 3-(4-nitrophenoxy)propyl-veratryl-amine Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCCCOC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNCCCOC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C18H22N2O5/c1-23-17-9-4-14(12-18(17)24-2)13-19-10-3-11-25-16-7-5-15(6-8-16)20(21)22/h4-9,12,19H,3,10-11,13H2,1-2H3