3-bromanyl-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-methoxy-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-methoxy-4-propoxy-benzamide Openeye Name: 3-bromo-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-methoxy-4-propoxy-benzamide CAS Name: 3-bromo-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-methoxy-4-propoxybenzamide IUPAC Name: 3-bromo-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-methoxy-4-propoxybenzamide Traditional Name: 3-bromo-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-methoxy-4-propoxy-benzamide Formula: C22H26BrNO5 MolecularWeight: 464.34954

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)NC(C)C2=CC3=C(C=C2)OCCCO3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)NC(C)C2=CC3=C(C=C2)OCCCO3)OC

InChI

InChI=1S/C22H26BrNO5/c1-4-8-29-21-17(23)11-16(13-20(21)26-3)22(25)24-14(2)15-6-7-18-19(12-15)28-10-5-9-27-18/h6-7,11-14H,4-5,8-10H2,1-3H3,(H,24,25)