6-chloranyl-N-[(4-ethylphenyl)methyl]-1,3-benzodioxol-5-amine

Systemtic Name: 6-chloranyl-N-[(4-ethylphenyl)methyl]-1,3-benzodioxol-5-amine Openeye Name: 6-chloro-N-[(4-ethylphenyl)methyl]-1,3-benzodioxol-5-amine CAS Name: 6-chloro-N-[(4-ethylphenyl)methyl]-1,3-benzodioxol-5-amine IUPAC Name: 6-chloro-N-[(4-ethylphenyl)methyl]-1,3-benzodioxol-5-amine Traditional Name: (6-chloro-1,3-benzodioxol-5-yl)-(4-ethylbenzyl)amine Formula: C16H16ClNO2 MolecularWeight: 289.75674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC2=CC3=C(C=C2Cl)OCO3

Isomeric SMILES

CCC1=CC=C(C=C1)CNC2=CC3=C(C=C2Cl)OCO3

InChI

InChI=1S/C16H16ClNO2/c1-2-11-3-5-12(6-4-11)9-18-14-8-16-15(7-13(14)17)19-10-20-16/h3-8,18H,2,9-10H2,1H3