[4-[[2-(azaniumylmethyl)phenyl]amino]-4-oxidanylidene-butyl]-dipropyl-azanium

Systemtic Name: [4-[[2-(azaniumylmethyl)phenyl]amino]-4-oxidanylidene-butyl]-dipropyl-azanium Openeye Name: [4-[2-(azaniumylmethyl)anilino]-4-oxo-butyl]-dipropyl-ammonium CAS Name: [4-[2-(ammoniomethyl)anilino]-4-oxobutyl]-dipropylammonium IUPAC Name: [4-[2-(azaniumylmethyl)anilino]-4-oxobutyl]-dipropylazanium Traditional Name: [4-[2-(ammoniomethyl)anilino]-4-keto-butyl]-dipropyl-ammonium Formula: C17H31N3O+2 MolecularWeight: 293.44754

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CCCC(=O)NC1=CC=CC=C1C[NH3+]

Isomeric SMILES

CCC[NH+](CCC)CCCC(=O)NC1=CC=CC=C1C[NH3+]

InChI

InChI=1S/C17H29N3O/c1-3-11-20(12-4-2)13-7-10-17(21)19-16-9-6-5-8-15(16)14-18/h5-6,8-9H,3-4,7,10-14,18H2,1-2H3,(H,19,21)/p+2