N-[2-[2-butyl-5-chloranyl-1-(4-chlorophenyl)carbonyl-1-methoxy-indol-1-ium-3-yl]ethyl]methanamide

Systemtic Name: N-[2-[2-butyl-5-chloranyl-1-(4-chlorophenyl)carbonyl-1-methoxy-indol-1-ium-3-yl]ethyl]methanamide Openeye Name: N-[2-[2-butyl-5-chloro-1-(4-chlorobenzoyl)-1-methoxy-indol-1-ium-3-yl]ethyl]formamide CAS Name: N-[2-[2-butyl-5-chloro-1-[(4-chlorophenyl)-oxomethyl]-1-methoxy-3-indol-1-iumyl]ethyl]formamide IUPAC Name: N-[2-[2-butyl-5-chloro-1-(4-chlorobenzoyl)-1-methoxyindol-1-ium-3-yl]ethyl]formamide Traditional Name: N-[2-[2-butyl-5-chloro-1-(4-chlorobenzoyl)-1-methoxy-indol-1-ium-3-yl]ethyl]formamide Formula: C23H25Cl2N2O3+ MolecularWeight: 448.3622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C([N+]1(C(=O)C3=CC=C(C=C3)Cl)OC)C=CC(=C2)Cl)CCNC=O

Isomeric SMILES

CCCCC1=C(C2=C([N+]1(C(=O)C3=CC=C(C=C3)Cl)OC)C=CC(=C2)Cl)CCNC=O

InChI

InChI=1S/C23H24Cl2N2O3/c1-3-4-5-21-19(12-13-26-15-28)20-14-18(25)10-11-22(20)27(21,30-2)23(29)16-6-8-17(24)9-7-16/h6-11,14-15H,3-5,12-13H2,1-2H3/p+1