4-chloranylaniline; 2-methylbutyl benzenecarboperoxoate

Systemtic Name: 4-chloranylaniline; 2-methylbutyl benzenecarboperoxoate Openeye Name: 4-chloroaniline; 2-methylbutyl benzenecarboperoxoate CAS Name: benzenecarboperoxoic acid 2-methylbutyl ester; 4-chloroaniline IUPAC Name: 4-chloroaniline; 2-methylbutyl benzenecarboperoxoate Traditional Name: benzenecarboperoxoic acid 2-methylbutyl ester; (4-chlorophenyl)amine Formula: C18H22ClNO3 MolecularWeight: 335.82518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COOC(=O)C1=CC=CC=C1.C1=CC(=CC=C1N)Cl

Isomeric SMILES

CCC(C)COOC(=O)C1=CC=CC=C1.C1=CC(=CC=C1N)Cl

InChI

InChI=1S/C12H16O3.C6H6ClN/c1-3-10(2)9-14-15-12(13)11-7-5-4-6-8-11;7-5-1-3-6(8)4-2-5/h4-8,10H,3,9H2,1-2H3;1-4H,8H2