N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(5-methylthiophen-2-yl)methyl]ethanamine

Systemtic Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(5-methylthiophen-2-yl)methyl]ethanamine Openeye Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(5-methyl-2-thienyl)methyl]ethanamine CAS Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(5-methyl-2-thiophenyl)methyl]ethanamine IUPAC Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(5-methylthiophen-2-yl)methyl]ethanamine Traditional Name: [3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(5-methyl-2-thienyl)methyl]-ethyl-amine Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(C1=CC2=C(C=C1)OCCCO2)C3=CC=C(S3)C

Isomeric SMILES

CCNC(C1=CC2=C(C=C1)OCCCO2)C3=CC=C(S3)C

InChI

InChI=1S/C17H21NO2S/c1-3-18-17(16-8-5-12(2)21-16)13-6-7-14-15(11-13)20-10-4-9-19-14/h5-8,11,17-18H,3-4,9-10H2,1-2H3