N-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]pentan-3-amine

Systemtic Name: N-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]pentan-3-amine Openeye Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]pentan-3-amine CAS Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-3-pentanamine IUPAC Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]pentan-3-amine Traditional Name: (7-chloro-1,3-benzodioxol-5-yl)methyl-(1-ethylpropyl)amine Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC1=CC2=C(C(=C1)Cl)OCO2

Isomeric SMILES

CCC(CC)NCC1=CC2=C(C(=C1)Cl)OCO2

InChI

InChI=1S/C13H18ClNO2/c1-3-10(4-2)15-7-9-5-11(14)13-12(6-9)16-8-17-13/h5-6,10,15H,3-4,7-8H2,1-2H3