[5-chloranyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: [5-chloranyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(5-chloro-2,3-dioxo-indolin-1-yl)methyl]-ethyl-ammonium CAS Name: (5-chloro-2,3-dioxo-1-indolyl)methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(5-chloro-2,3-dioxoindol-1-yl)methyl]-ethylazanium Traditional Name: benzyl-[(5-chloro-2,3-diketo-indolin-1-yl)methyl]-ethyl-ammonium Formula: C18H18ClN2O2+ MolecularWeight: 329.80072

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CN2C3=C(C=C(C=C3)Cl)C(=O)C2=O

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CN2C3=C(C=C(C=C3)Cl)C(=O)C2=O

InChI

InChI=1S/C18H17ClN2O2/c1-2-20(11-13-6-4-3-5-7-13)12-21-16-9-8-14(19)10-15(16)17(22)18(21)23/h3-10H,2,11-12H2,1H3/p+1