N-[2,3-bis(chloranyl)phenyl]-4-(4-phenylbutyl)morpholin-4-ium-2-carboxamide

Systemtic Name: N-[2,3-bis(chloranyl)phenyl]-4-(4-phenylbutyl)morpholin-4-ium-2-carboxamide Openeye Name: N-(2,3-dichlorophenyl)-4-(4-phenylbutyl)morpholin-4-ium-2-carboxamide CAS Name: N-(2,3-dichlorophenyl)-4-(4-phenylbutyl)-2-morpholin-4-iumcarboxamide IUPAC Name: N-(2,3-dichlorophenyl)-4-(4-phenylbutyl)morpholin-4-ium-2-carboxamide Traditional Name: N-(2,3-dichlorophenyl)-4-(4-phenylbutyl)morpholin-4-ium-2-carboxamide Formula: C21H25Cl2N2O2+ MolecularWeight: 408.3414

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C[NH+]1CCCCC2=CC=CC=C2)C(=O)NC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1COC(C[NH+]1CCCCC2=CC=CC=C2)C(=O)NC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C21H24Cl2N2O2/c22-17-10-6-11-18(20(17)23)24-21(26)19-15-25(13-14-27-19)12-5-4-9-16-7-2-1-3-8-16/h1-3,6-8,10-11,19H,4-5,9,12-15H2,(H,24,26)/p+1