butyl benzenecarboperoxoate; 4-chloranylaniline; hydrochloride

Systemtic Name: butyl benzenecarboperoxoate; 4-chloranylaniline; hydrochloride Openeye Name: butyl benzenecarboperoxoate; 4-chloroaniline; hydrochloride CAS Name: benzenecarboperoxoic acid butyl ester; 4-chloroaniline; hydrochloride IUPAC Name: butyl benzenecarboperoxoate; 4-chloroaniline; hydrochloride Traditional Name: benzenecarboperoxoic acid butyl ester; (4-chlorophenyl)amine; hydrochloride Formula: C17H21Cl2NO3 MolecularWeight: 358.25954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOOC(=O)C1=CC=CC=C1.C1=CC(=CC=C1N)Cl.Cl

Isomeric SMILES

CCCCOOC(=O)C1=CC=CC=C1.C1=CC(=CC=C1N)Cl.Cl

InChI

InChI=1S/C11H14O3.C6H6ClN.ClH/c1-2-3-9-13-14-11(12)10-7-5-4-6-8-10;7-5-1-3-6(8)4-2-5;/h4-8H,2-3,9H2,1H3;1-4H,8H2;1H