3-(azepan-1-ylcarbonyl)benzamide; benzene-1,4-dicarboxamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)benzamide; benzene-1,4-dicarboxamide Openeye Name: 3-(azepane-1-carbonyl)benzamide; terephthalamide CAS Name: 3-[1-azepanyl(oxo)methyl]benzamide; benzene-1,4-dicarboxamide IUPAC Name: 3-(azepane-1-carbonyl)benzamide; benzene-1,4-dicarboxamide Traditional Name: 3-(azepane-1-carbonyl)benzamide; terephthalamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)C(=O)N.C1=CC(=CC=C1C(=O)N)C(=O)N

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)C(=O)N.C1=CC(=CC=C1C(=O)N)C(=O)N

InChI

InChI=1S/C14H18N2O2.C8H8N2O2/c15-13(17)11-6-5-7-12(10-11)14(18)16-8-3-1-2-4-9-16;9-7(11)5-1-2-6(4-3-5)8(10)12/h5-7,10H,1-4,8-9H2,(H2,15,17);1-4H,(H2,9,11)(H2,10,12)