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

Systemtic Name: 3-[[4-[(1,3-dimethyl-2H-imidazol-2-yl)diazenyl]phenyl]amino]butyl-pentan-3-yl-azanium Openeye Name: 3-[4-[(1,3-dimethyl-2H-imidazol-2-yl)azo]anilino]butyl-(1-ethylpropyl)ammonium CAS Name: 3-[4-[(1,3-dimethyl-2H-imidazol-2-yl)azo]anilino]butyl-pentan-3-ylammonium IUPAC Name: 3-[4-[(1,3-dimethyl-2H-imidazol-2-yl)diazenyl]anilino]butyl-pentan-3-ylazanium Traditional Name: 3-[4-[(1,3-dimethyl-4-imidazolin-2-yl)azo]anilino]butyl-(1-ethylpropyl)ammonium Formula: C20H35N6+ MolecularWeight: 359.5321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H34N6/c1-6-17(7-2)21-13-12-16(3)22-18-8-10-19(11-9-18)23-24-20-25(4)14-15-26(20)5/h8-11,14-17,20-22H,6-7,12-13H2,1-5H3/p+1