4-[2-nitro-1-[oxidanyl(1-phenylpropan-2-yl)amino]propyl]phenol

Systemtic Name: 4-[2-nitro-1-[oxidanyl(1-phenylpropan-2-yl)amino]propyl]phenol Openeye Name: 4-[1-[hydroxy-(1-methyl-2-phenyl-ethyl)amino]-2-nitro-propyl]phenol CAS Name: 4-[1-[hydroxy(1-phenylpropan-2-yl)amino]-2-nitropropyl]phenol IUPAC Name: 4-[1-[hydroxy(1-phenylpropan-2-yl)amino]-2-nitropropyl]phenol Traditional Name: 4-[1-[hydroxy-(1-methyl-2-phenyl-ethyl)amino]-2-nitro-propyl]phenol Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O4/c1-13(12-15-6-4-3-5-7-15)19(22)18(14(2)20(23)24)16-8-10-17(21)11-9-16/h3-11,13-14,18,21-22H,12H2,1-2H3