3-nitro-4-(3-phenylpropoxy)aniline hydrochloride

Systemtic Name: 3-nitro-4-(3-phenylpropoxy)aniline hydrochloride Openeye Name: 3-nitro-4-(3-phenylpropoxy)aniline hydrochloride CAS Name: 3-nitro-4-(3-phenylpropoxy)aniline hydrochloride IUPAC Name: 3-nitro-4-(3-phenylpropoxy)aniline hydrochloride Traditional Name: [3-nitro-4-(3-phenylpropoxy)phenyl]amine hydrochloride Formula: C15H17ClN2O3 MolecularWeight: 308.76008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)N)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)N)[N+](=O)[O-].Cl

InChI

InChI=1S/C15H16N2O3.ClH/c16-13-8-9-15(14(11-13)17(18)19)20-10-4-7-12-5-2-1-3-6-12;/h1-3,5-6,8-9,11H,4,7,10,16H2;1H