5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(5-methylhexan-2-yl)pyrrole-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(5-methylhexan-2-yl)pyrrole-3-carboxamide Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(1,4-dimethylpentyl)-2-methyl-pyrrole-3-carboxamide CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(5-methylhexan-2-yl)-3-pyrrolecarboxamide IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(5-methylhexan-2-yl)pyrrole-3-carboxamide Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(1,4-dimethylpentyl)-2-methyl-pyrrole-3-carboxamide Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C(C)CCC(C)C)C2=CC3=C(C=C2)OCCCO3)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1C(C)CCC(C)C)C2=CC3=C(C=C2)OCCCO3)C(=O)N

InChI

InChI=1S/C22H30N2O3/c1-14(2)6-7-15(3)24-16(4)18(22(23)25)13-19(24)17-8-9-20-21(12-17)27-11-5-10-26-20/h8-9,12-15H,5-7,10-11H2,1-4H3,(H2,23,25)