2-chloranyl-10,10-dimethyl-6-oxidanyl-7-(phenylmethyl)-7H-pyrido[1,2-a]indol-5-ium-8-one

Systemtic Name: 2-chloranyl-10,10-dimethyl-6-oxidanyl-7-(phenylmethyl)-7H-pyrido[1,2-a]indol-5-ium-8-one Openeye Name: 7-benzyl-2-chloro-6-hydroxy-10,10-dimethyl-7H-pyrido[1,2-a]indol-5-ium-8-one CAS Name: 2-chloro-6-hydroxy-10,10-dimethyl-7-(phenylmethyl)-7H-pyrido[1,2-a]indol-5-ium-8-one IUPAC Name: 7-benzyl-2-chloro-6-hydroxy-10,10-dimethyl-7H-pyrido[1,2-a]indol-5-ium-8-one Traditional Name: 7-benzyl-2-chloro-6-hydroxy-10,10-dimethyl-7H-pyrid[1,2-a]indol-5-ium-8-one Formula: C21H19ClNO2+ MolecularWeight: 352.83406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=O)C(C(=[N+]2C3=C1C=C(C=C3)Cl)O)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(C2=CC(=O)C(C(=[N+]2C3=C1C=C(C=C3)Cl)O)CC4=CC=CC=C4)C

InChI

InChI=1S/C21H18ClNO2/c1-21(2)16-11-14(22)8-9-17(16)23-19(21)12-18(24)15(20(23)25)10-13-6-4-3-5-7-13/h3-9,11-12,15H,10H2,1-2H3/p+1