N-(4-chlorophenyl)-4-(phenylmethyl)-1,4-diazepan-4-ium-1-carboxamide

Systemtic Name: N-(4-chlorophenyl)-4-(phenylmethyl)-1,4-diazepan-4-ium-1-carboxamide Openeye Name: 4-benzyl-N-(4-chlorophenyl)-1,4-diazepan-4-ium-1-carboxamide CAS Name: N-(4-chlorophenyl)-4-(phenylmethyl)-1,4-diazepan-4-ium-1-carboxamide IUPAC Name: 4-benzyl-N-(4-chlorophenyl)-1,4-diazepan-4-ium-1-carboxamide Traditional Name: 4-benzyl-N-(4-chlorophenyl)-1,4-diazepan-4-ium-1-carboxamide Formula: C19H23ClN3O+ MolecularWeight: 344.85842

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN(C1)C(=O)NC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCN(C1)C(=O)NC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H22ClN3O/c20-17-7-9-18(10-8-17)21-19(24)23-12-4-11-22(13-14-23)15-16-5-2-1-3-6-16/h1-3,5-10H,4,11-15H2,(H,21,24)/p+1