N-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-2-phenyl-ethanamine

Systemtic Name: N-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-2-phenyl-ethanamine Openeye Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-2-phenyl-ethanamine CAS Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-2-phenylethanamine IUPAC Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-2-phenylethanamine Traditional Name: (7-chloro-1,3-benzodioxol-5-yl)methyl-phenethyl-amine Formula: C16H16ClNO2 MolecularWeight: 289.75674

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)CNCCC3=CC=CC=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)CNCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C16H16ClNO2/c17-14-8-13(9-15-16(14)20-11-19-15)10-18-7-6-12-4-2-1-3-5-12/h1-5,8-9,18H,6-7,10-11H2