2-[[3-(7-chloranyl-1H-quinolin-4-ylidene)-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]methyl-methyl-amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[3-(7-chloranyl-1H-quinolin-4-ylidene)-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]methyl-methyl-amino]ethyl-diethyl-azanium Openeye Name: 2-[[3-(7-chloro-1H-quinolin-4-ylidene)-6-oxo-cyclohexa-1,4-dien-1-yl]methyl-methyl-amino]ethyl-diethyl-ammonium CAS Name: 2-[[3-(7-chloro-1H-quinolin-4-ylidene)-6-oxo-1-cyclohexa-1,4-dienyl]methyl-methylamino]ethyl-diethylammonium IUPAC Name: 2-[[3-(7-chloro-1H-quinolin-4-ylidene)-6-oxocyclohexa-1,4-dien-1-yl]methyl-methylamino]ethyl-diethylazanium Traditional Name: 2-[[3-(7-chloro-1H-quinolin-4-ylidene)-6-keto-cyclohexa-1,4-dien-1-yl]methyl-methyl-amino]ethyl-diethyl-ammonium Formula: C23H29ClN3O+ MolecularWeight: 398.94886

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C)CC1=CC(=C2C=CNC3=C2C=CC(=C3)Cl)C=CC1=O

Isomeric SMILES

CC[NH+](CC)CCN(C)CC1=CC(=C2C=CNC3=C2C=CC(=C3)Cl)C=CC1=O

InChI

InChI=1S/C23H28ClN3O/c1-4-27(5-2)13-12-26(3)16-18-14-17(6-9-23(18)28)20-10-11-25-22-15-19(24)7-8-21(20)22/h6-11,14-15,25H,4-5,12-13,16H2,1-3H3/p+1