[(4E)-4-[[4-[bis(2-hydroxyethyl)amino]-2-methyl-phenyl]-(2-chlorophenyl)methylidene]-3-methyl-cyclohexa-2,5-dien-1-ylidene]-bis(2-hydroxyethyl)azanium

Systemtic Name: [(4E)-4-[[4-[bis(2-hydroxyethyl)amino]-2-methyl-phenyl]-(2-chlorophenyl)methylidene]-3-methyl-cyclohexa-2,5-dien-1-ylidene]-bis(2-hydroxyethyl)azanium Openeye Name: [(4E)-4-[[4-[bis(2-hydroxyethyl)amino]-2-methyl-phenyl]-(2-chlorophenyl)methylene]-3-methyl-cyclohexa-2,5-dien-1-ylidene]-bis(2-hydroxyethyl)ammonium CAS Name: [(4E)-4-[[4-[bis(2-hydroxyethyl)amino]-2-methylphenyl]-(2-chlorophenyl)methylidene]-3-methyl-1-cyclohexa-2,5-dienylidene]-bis(2-hydroxyethyl)ammonium IUPAC Name: [(4E)-4-[[4-[bis(2-hydroxyethyl)amino]-2-methylphenyl]-(2-chlorophenyl)methylidene]-3-methylcyclohexa-2,5-dien-1-ylidene]-bis(2-hydroxyethyl)azanium Traditional Name: [(4E)-4-[[4-[bis(2-hydroxyethyl)amino]-2-methyl-phenyl]-(2-chlorophenyl)methylene]-3-methyl-cyclohexa-2,5-dien-1-ylidene]-bis(2-hydroxyethyl)ammonium Formula: C29H36ClN2O4+ MolecularWeight: 512.06014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](CCO)CCO)C=CC1=C(C2=C(C=C(C=C2)N(CCO)CCO)C)C3=CC=CC=C3Cl

Isomeric SMILES

CC\1=CC(=[N+](CCO)CCO)C=C/C1=C(/C2=C(C=C(C=C2)N(CCO)CCO)C)\C3=CC=CC=C3Cl

InChI

InChI=1S/C29H36ClN2O4/c1-21-19-23(31(11-15-33)12-16-34)7-9-25(21)29(27-5-3-4-6-28(27)30)26-10-8-24(20-22(26)2)32(13-17-35)14-18-36/h3-10,19-20,33-36H,11-18H2,1-2H3/q+1