N-(4-butylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(4-butylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(4-butylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(4-butylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(4-butylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(4-butylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2C)OCCCO3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2C)OCCCO3

InChI

InChI=1S/C21H25NO3/c1-3-4-6-16-7-9-17(10-8-16)22-21(23)18-14-20-19(13-15(18)2)24-11-5-12-25-20/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,22,23)