[6-[3-[(4-chlorophenyl)carbamoyl-phenyl-amino]propylamino]-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-[3-[(4-chlorophenyl)carbamoyl-phenyl-amino]propylamino]-6-oxidanylidene-hexyl]azanium Openeye Name: [6-[3-[N-[(4-chlorophenyl)carbamoyl]anilino]propylamino]-6-oxo-hexyl]ammonium CAS Name: [6-[3-(N-[(4-chloroanilino)-oxomethyl]anilino)propylamino]-6-oxohexyl]ammonium IUPAC Name: [6-[3-[N-[(4-chlorophenyl)carbamoyl]anilino]propylamino]-6-oxohexyl]azanium Traditional Name: [6-[3-[N-[(4-chlorophenyl)carbamoyl]anilino]propylamino]-6-keto-hexyl]ammonium Formula: C22H30ClN4O2+ MolecularWeight: 417.9522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCCNC(=O)CCCCC[NH3+])C(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)N(CCCNC(=O)CCCCC[NH3+])C(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H29ClN4O2/c23-18-11-13-19(14-12-18)26-22(29)27(20-8-3-1-4-9-20)17-7-16-25-21(28)10-5-2-6-15-24/h1,3-4,8-9,11-14H,2,5-7,10,15-17,24H2,(H,25,28)(H,26,29)/p+1