[6-[3-[(2-methoxyphenyl)carbamoyl-phenyl-amino]propylamino]-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-[3-[(2-methoxyphenyl)carbamoyl-phenyl-amino]propylamino]-6-oxidanylidene-hexyl]azanium Openeye Name: [6-[3-[N-[(2-methoxyphenyl)carbamoyl]anilino]propylamino]-6-oxo-hexyl]ammonium CAS Name: [6-[3-(N-[(2-methoxyanilino)-oxomethyl]anilino)propylamino]-6-oxohexyl]ammonium IUPAC Name: [6-[3-[N-[(2-methoxyphenyl)carbamoyl]anilino]propylamino]-6-oxohexyl]azanium Traditional Name: [6-keto-6-[3-[N-[(2-methoxyphenyl)carbamoyl]anilino]propylamino]hexyl]ammonium Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)N(CCCNC(=O)CCCCC[NH3+])C2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N(CCCNC(=O)CCCCC[NH3+])C2=CC=CC=C2

InChI

InChI=1S/C23H32N4O3/c1-30-21-14-8-7-13-20(21)26-23(29)27(19-11-4-2-5-12-19)18-10-17-25-22(28)15-6-3-9-16-24/h2,4-5,7-8,11-14H,3,6,9-10,15-18,24H2,1H3,(H,25,28)(H,26,29)/p+1