1-(3-nitro-4-phenylmethoxy-phenyl)-2-(propan-2-ylamino)propan-1-ol hydrochloride

Systemtic Name: 1-(3-nitro-4-phenylmethoxy-phenyl)-2-(propan-2-ylamino)propan-1-ol hydrochloride Openeye Name: 1-(4-benzyloxy-3-nitro-phenyl)-2-(isopropylamino)propan-1-ol hydrochloride CAS Name: 1-(3-nitro-4-phenylmethoxyphenyl)-2-(propan-2-ylamino)-1-propanol hydrochloride IUPAC Name: 1-(3-nitro-4-phenylmethoxyphenyl)-2-(propan-2-ylamino)propan-1-ol hydrochloride Traditional Name: 1-(4-benzoxy-3-nitro-phenyl)-2-(isopropylamino)propan-1-ol hydrochloride Formula: C19H25ClN2O4 MolecularWeight: 380.8658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(C)C(C1=CC(=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-])O.Cl

Isomeric SMILES

CC(C)NC(C)C(C1=CC(=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C19H24N2O4.ClH/c1-13(2)20-14(3)19(22)16-9-10-18(17(11-16)21(23)24)25-12-15-7-5-4-6-8-15;/h4-11,13-14,19-20,22H,12H2,1-3H3;1H