1-[2-(1,3-benzoxazol-2-yl)ethylamino]-3-(4-nitrophenoxy)propan-2-ol hydrochloride

Systemtic Name: 1-[2-(1,3-benzoxazol-2-yl)ethylamino]-3-(4-nitrophenoxy)propan-2-ol hydrochloride Openeye Name: 1-[2-(1,3-benzoxazol-2-yl)ethylamino]-3-(4-nitrophenoxy)propan-2-ol hydrochloride CAS Name: 1-[2-(1,3-benzoxazol-2-yl)ethylamino]-3-(4-nitrophenoxy)-2-propanol hydrochloride IUPAC Name: 1-[2-(1,3-benzoxazol-2-yl)ethylamino]-3-(4-nitrophenoxy)propan-2-ol hydrochloride Traditional Name: 1-[2-(1,3-benzoxazol-2-yl)ethylamino]-3-(4-nitrophenoxy)propan-2-ol hydrochloride Formula: C18H20ClN3O5 MolecularWeight: 393.8215

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)CCNCC(COC3=CC=C(C=C3)[N+](=O)[O-])O.Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)CCNCC(COC3=CC=C(C=C3)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C18H19N3O5.ClH/c22-14(12-25-15-7-5-13(6-8-15)21(23)24)11-19-10-9-18-20-16-3-1-2-4-17(16)26-18;/h1-8,14,19,22H,9-12H2;1H