N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C17H18ClNO3S MolecularWeight: 351.84772

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)C(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)C(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H18ClNO3S/c1-2-19(11-13-5-7-16(18)23-13)17(20)12-4-6-14-15(10-12)22-9-3-8-21-14/h4-7,10H,2-3,8-9,11H2,1H3