1-(3-methylphenoxy)-3-[2-[(3-nitrophenyl)amino]ethylamino]propan-2-ol hydrochloride

Systemtic Name: 1-(3-methylphenoxy)-3-[2-[(3-nitrophenyl)amino]ethylamino]propan-2-ol hydrochloride Openeye Name: 1-(3-methylphenoxy)-3-[2-(3-nitroanilino)ethylamino]propan-2-ol hydrochloride CAS Name: 1-(3-methylphenoxy)-3-[2-(3-nitroanilino)ethylamino]-2-propanol hydrochloride IUPAC Name: 1-(3-methylphenoxy)-3-[2-(3-nitroanilino)ethylamino]propan-2-ol hydrochloride Traditional Name: 1-(3-methylphenoxy)-3-[2-(3-nitroanilino)ethylamino]propan-2-ol hydrochloride Formula: C18H24ClN3O4 MolecularWeight: 381.85386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CNCCNC2=CC(=CC=C2)[N+](=O)[O-])O.Cl

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CNCCNC2=CC(=CC=C2)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C18H23N3O4.ClH/c1-14-4-2-7-18(10-14)25-13-17(22)12-19-8-9-20-15-5-3-6-16(11-15)21(23)24;/h2-7,10-11,17,19-20,22H,8-9,12-13H2,1H3;1H