N-[2-(azepan-1-ylcarbonyl)phenyl]-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-3-iodo-4-methyl-benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-3-iodo-4-methylbenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-3-iodo-4-methyl-benzamide Formula: C21H23IN2O2 MolecularWeight: 462.32399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)I

InChI

InChI=1S/C21H23IN2O2/c1-15-10-11-16(14-18(15)22)20(25)23-19-9-5-4-8-17(19)21(26)24-12-6-2-3-7-13-24/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3,(H,23,25)