4-[2,3-bis(chloranyl)phenyl]carbonyl-N-phenethyl-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[2,3-bis(chloranyl)phenyl]carbonyl-N-phenethyl-1,4-diazepane-1-carboxamide Openeye Name: 4-(2,3-dichlorobenzoyl)-N-phenethyl-1,4-diazepane-1-carboxamide CAS Name: 4-[(2,3-dichlorophenyl)-oxomethyl]-N-phenethyl-1,4-diazepane-1-carboxamide IUPAC Name: 4-(2,3-dichlorobenzoyl)-N-phenethyl-1,4-diazepane-1-carboxamide Traditional Name: 4-(2,3-dichlorobenzoyl)-N-phenethyl-1,4-diazepane-1-carboxamide Formula: C21H23Cl2N3O2 MolecularWeight: 420.33222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCCC2=CC=CC=C2)C(=O)C3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCCC2=CC=CC=C2)C(=O)C3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O2/c22-18-9-4-8-17(19(18)23)20(27)25-12-5-13-26(15-14-25)21(28)24-11-10-16-6-2-1-3-7-16/h1-4,6-9H,5,10-15H2,(H,24,28)