2-chloranyl-3-[[6-chloranyl-3-methoxy-5-(2-methylpropyl)-4-oxidanidyl-pyrazin-4-ium-2-yl]methyl]-1H-indole

Systemtic Name: 2-chloranyl-3-[[6-chloranyl-3-methoxy-5-(2-methylpropyl)-4-oxidanidyl-pyrazin-4-ium-2-yl]methyl]-1H-indole Openeye Name: 2-chloro-3-[(6-chloro-5-isobutyl-3-methoxy-4-oxido-pyrazin-4-ium-2-yl)methyl]-1H-indole CAS Name: 2-chloro-3-[[6-chloro-3-methoxy-5-(2-methylpropyl)-4-oxido-2-pyrazin-4-iumyl]methyl]-1H-indole IUPAC Name: 2-chloro-3-[[6-chloro-3-methoxy-5-(2-methylpropyl)-4-oxidopyrazin-4-ium-2-yl]methyl]-1H-indole Traditional Name: 2-chloro-3-[(6-chloro-5-isobutyl-3-methoxy-4-oxido-pyrazin-4-ium-2-yl)methyl]-1H-indole Formula: C18H19Cl2N3O2 MolecularWeight: 380.26836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[N+](C(=C(N=C1Cl)CC2=C(NC3=CC=CC=C32)Cl)OC)[O-]

Isomeric SMILES

CC(C)CC1=[N+](C(=C(N=C1Cl)CC2=C(NC3=CC=CC=C32)Cl)OC)[O-]

InChI

InChI=1S/C18H19Cl2N3O2/c1-10(2)8-15-17(20)22-14(18(25-3)23(15)24)9-12-11-6-4-5-7-13(11)21-16(12)19/h4-7,10,21H,8-9H2,1-3H3