(4-chlorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine

Systemtic Name: (4-chlorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine Openeye Name: (4-chlorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine CAS Name: (4-chlorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine IUPAC Name: (4-chlorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine Traditional Name: [(4-chlorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]amine Formula: C16H16ClNO2 MolecularWeight: 289.75674

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(C3=CC=C(C=C3)Cl)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(C3=CC=C(C=C3)Cl)N)OC1

InChI

InChI=1S/C16H16ClNO2/c17-13-5-2-11(3-6-13)16(18)12-4-7-14-15(10-12)20-9-1-8-19-14/h2-7,10,16H,1,8-9,18H2