(E)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-thiophen-3-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-thiophen-3-yl-prop-2-en-1-one Openeye Name: (E)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-(3-thienyl)prop-2-en-1-one CAS Name: (E)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3-(3-thiophenyl)-2-propen-1-one IUPAC Name: (E)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-thiophen-3-ylprop-2-en-1-one Traditional Name: (E)-1-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3-(3-thienyl)prop-2-en-1-one Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C=CC2=CSC=C2)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)/C=C/C2=CSC=C2)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H21NO3S/c22-20(7-4-15-8-12-25-14-15)21-9-1-3-17(21)16-5-6-18-19(13-16)24-11-2-10-23-18/h4-8,12-14,17H,1-3,9-11H2/b7-4+/t17-/m1/s1