4-[5,7-bis(chloranyl)-2-pyridin-3-yl-1H-indol-3-yl]butylazanium

Systemtic Name: 4-[5,7-bis(chloranyl)-2-pyridin-3-yl-1H-indol-3-yl]butylazanium Openeye Name: 4-[5,7-dichloro-2-(3-pyridyl)-1H-indol-3-yl]butylammonium CAS Name: 4-[5,7-dichloro-2-(3-pyridinyl)-1H-indol-3-yl]butylammonium IUPAC Name: 4-(5,7-dichloro-2-pyridin-3-yl-1H-indol-3-yl)butylazanium Traditional Name: 4-[5,7-dichloro-2-(3-pyridyl)-1H-indol-3-yl]butylammonium Formula: C17H18Cl2N3+ MolecularWeight: 335.25092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=C(C3=CC(=CC(=C3N2)Cl)Cl)CCCC[NH3+]

Isomeric SMILES

C1=CC(=CN=C1)C2=C(C3=CC(=CC(=C3N2)Cl)Cl)CCCC[NH3+]

InChI

InChI=1S/C17H17Cl2N3/c18-12-8-14-13(5-1-2-6-20)16(11-4-3-7-21-10-11)22-17(14)15(19)9-12/h3-4,7-10,22H,1-2,5-6,20H2/p+1