1-[2-(3,5-dimethylphenoxy)ethyl-methyl-amino]-3-(3-nitrophenoxy)propan-2-ol

Systemtic Name: 1-[2-(3,5-dimethylphenoxy)ethyl-methyl-amino]-3-(3-nitrophenoxy)propan-2-ol Openeye Name: 1-[2-(3,5-dimethylphenoxy)ethyl-methyl-amino]-3-(3-nitrophenoxy)propan-2-ol CAS Name: 1-[2-(3,5-dimethylphenoxy)ethyl-methylamino]-3-(3-nitrophenoxy)-2-propanol IUPAC Name: 1-[2-(3,5-dimethylphenoxy)ethyl-methylamino]-3-(3-nitrophenoxy)propan-2-ol Traditional Name: 1-[2-(3,5-dimethylphenoxy)ethyl-methyl-amino]-3-(3-nitrophenoxy)propan-2-ol Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCN(C)CC(COC2=CC=CC(=C2)[N+](=O)[O-])O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCN(C)CC(COC2=CC=CC(=C2)[N+](=O)[O-])O)C

InChI

InChI=1S/C20H26N2O5/c1-15-9-16(2)11-20(10-15)26-8-7-21(3)13-18(23)14-27-19-6-4-5-17(12-19)22(24)25/h4-6,9-12,18,23H,7-8,13-14H2,1-3H3