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

Systemtic Name: N-[1-(5-methylthiophen-2-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[1-(5-methyl-2-thienyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[1-(5-methyl-2-thiophenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[1-(5-methylthiophen-2-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[1-(5-methyl-2-thienyl)ethyl]amine Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC=C(S1)C(C)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H19NO2S/c1-11-4-7-16(20-11)12(2)17-13-5-6-14-15(10-13)19-9-3-8-18-14/h4-7,10,12,17H,3,8-9H2,1-2H3