N-[1-(5-chloranylthiophen-2-yl)ethyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: N-[1-(5-chloranylthiophen-2-yl)ethyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: N-[1-(5-chloro-2-thienyl)ethyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: N-[1-(5-chloro-2-thiophenyl)ethyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: N-[1-(5-chlorothiophen-2-yl)ethyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: 1-(5-chloro-2-thienyl)ethyl-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amine Formula: C17H20ClNOS MolecularWeight: 321.8648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCCCC2NC(C)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC=CC2=C1OCCCC2NC(C)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H20ClNOS/c1-11-5-3-6-13-14(7-4-10-20-17(11)13)19-12(2)15-8-9-16(18)21-15/h3,5-6,8-9,12,14,19H,4,7,10H2,1-2H3