1-[4-(4-methyl-1,4-diazepan-1-yl)-3-nitro-phenyl]ethanol

Systemtic Name: 1-[4-(4-methyl-1,4-diazepan-1-yl)-3-nitro-phenyl]ethanol Openeye Name: 1-[4-(4-methyl-1,4-diazepan-1-yl)-3-nitro-phenyl]ethanol CAS Name: 1-[4-(4-methyl-1,4-diazepan-1-yl)-3-nitrophenyl]ethanol IUPAC Name: 1-[4-(4-methyl-1,4-diazepan-1-yl)-3-nitrophenyl]ethanol Traditional Name: 1-[4-(4-methyl-1,4-diazepan-1-yl)-3-nitro-phenyl]ethanol Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2CCCN(CC2)C)[N+](=O)[O-])O

Isomeric SMILES

CC(C1=CC(=C(C=C1)N2CCCN(CC2)C)[N+](=O)[O-])O

InChI

InChI=1S/C14H21N3O3/c1-11(18)12-4-5-13(14(10-12)17(19)20)16-7-3-6-15(2)8-9-16/h4-5,10-11,18H,3,6-9H2,1-2H3