3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-thiophen-3-ylpyrrolidin-1-yl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-thiophen-3-ylpyrrolidin-1-yl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-(3-thienyl)pyrrolidin-1-yl]methanone CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-(3-thiophenyl)-1-pyrrolidinyl]methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-thiophen-3-ylpyrrolidin-1-yl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-(3-thienyl)pyrrolidino]methanone Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)OCCCO3)C4=CSC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)OCCCO3)C4=CSC=C4

InChI

InChI=1S/C18H19NO3S/c20-18(19-7-1-3-15(19)14-6-10-23-12-14)13-4-5-16-17(11-13)22-9-2-8-21-16/h4-6,10-12,15H,1-3,7-9H2