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

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-ethylphenyl)methanamine Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-ethylphenyl)methanamine CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-ethylphenyl)methanamine IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-ethylphenyl)methanamine Traditional Name: [3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-ethylphenyl)methyl]amine Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC3=C(C=C2)OCCCO3)N

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC3=C(C=C2)OCCCO3)N

InChI

InChI=1S/C18H21NO2/c1-2-13-4-6-14(7-5-13)18(19)15-8-9-16-17(12-15)21-11-3-10-20-16/h4-9,12,18H,2-3,10-11,19H2,1H3