[4-[[4-[(1,3-dimethyl-2H-imidazol-2-yl)diazenyl]-3-methyl-phenyl]amino]-2-oxidanyl-pentyl]-pentan-3-yl-azanium

Systemtic Name: [4-[[4-[(1,3-dimethyl-2H-imidazol-2-yl)diazenyl]-3-methyl-phenyl]amino]-2-oxidanyl-pentyl]-pentan-3-yl-azanium Openeye Name: [4-[4-[(1,3-dimethyl-2H-imidazol-2-yl)azo]-3-methyl-anilino]-2-hydroxy-pentyl]-(1-ethylpropyl)ammonium CAS Name: [4-[4-[(1,3-dimethyl-2H-imidazol-2-yl)azo]-3-methylanilino]-2-hydroxypentyl]-pentan-3-ylammonium IUPAC Name: [4-[4-[(1,3-dimethyl-2H-imidazol-2-yl)diazenyl]-3-methylanilino]-2-hydroxypentyl]-pentan-3-ylazanium Traditional Name: [4-[4-[(1,3-dimethyl-4-imidazolin-2-yl)azo]-3-methyl-anilino]-2-hydroxy-pentyl]-(1-ethylpropyl)ammonium Formula: C22H39N6O+ MolecularWeight: 403.58466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC(CC(C)NC1=CC(=C(C=C1)N=NC2N(C=CN2C)C)C)O

Isomeric SMILES

CCC(CC)[NH2+]CC(CC(C)NC1=CC(=C(C=C1)N=NC2N(C=CN2C)C)C)O

InChI

InChI=1S/C22H38N6O/c1-7-18(8-2)23-15-20(29)14-17(4)24-19-9-10-21(16(3)13-19)25-26-22-27(5)11-12-28(22)6/h9-13,17-18,20,22-24,29H,7-8,14-15H2,1-6H3/p+1