N-(3-chloranyl-2,6-diethyl-phenyl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[2-(4-methoxyphenyl)azepan-1-yl]acetamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-2-[2-(4-methoxyphenyl)-1-azepanyl]acetamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-2-[2-(4-methoxyphenyl)azepan-1-yl]acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[2-(4-methoxyphenyl)azepan-1-yl]acetamide Formula: C25H33ClN2O2 MolecularWeight: 428.99472

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2CCCCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2CCCCCC2C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H33ClN2O2/c1-4-18-12-15-22(26)21(5-2)25(18)27-24(29)17-28-16-8-6-7-9-23(28)19-10-13-20(30-3)14-11-19/h10-15,23H,4-9,16-17H2,1-3H3,(H,27,29)