3-[2-(2,4-dichlorophenyl)ethylamino]azepan-2-one

Systemtic Name: 3-[2-(2,4-dichlorophenyl)ethylamino]azepan-2-one Openeye Name: 3-[2-(2,4-dichlorophenyl)ethylamino]azepan-2-one CAS Name: 3-[2-(2,4-dichlorophenyl)ethylamino]-2-azepanone IUPAC Name: 3-[2-(2,4-dichlorophenyl)ethylamino]azepan-2-one Traditional Name: 3-[2-(2,4-dichlorophenyl)ethylamino]azepan-2-one Formula: C14H18Cl2N2O MolecularWeight: 301.21152

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)NCCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H18Cl2N2O/c15-11-5-4-10(12(16)9-11)6-8-17-13-3-1-2-7-18-14(13)19/h4-5,9,13,17H,1-3,6-8H2,(H,18,19)