[4-[bis[4-[2-cyanoethyl(methyl)amino]phenyl]methylidene]naphthalen-1-ylidene]-phenyl-azanium chloride

Systemtic Name: [4-[bis[4-[2-cyanoethyl(methyl)amino]phenyl]methylidene]naphthalen-1-ylidene]-phenyl-azanium chloride Openeye Name: [4-[bis[4-[2-cyanoethyl(methyl)amino]phenyl]methylene]-1-naphthylidene]-phenyl-ammonium chloride CAS Name: [4-[bis[4-[2-cyanoethyl(methyl)amino]phenyl]methylidene]-1-naphthalenylidene]-phenylammonium chloride IUPAC Name: [4-[bis[4-[2-cyanoethyl(methyl)amino]phenyl]methylidene]naphthalen-1-ylidene]-phenylazanium chloride Traditional Name: [4-[bis[4-[2-cyanoethyl(methyl)amino]phenyl]methylene]-1-naphthylidene]-phenyl-ammonium chloride Formula: C37H34ClN5 MolecularWeight: 584.15236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=CC=C(C=C1)C(=C2C=CC(=[NH+]C3=CC=CC=C3)C4=CC=CC=C24)C5=CC=C(C=C5)N(C)CCC#N.[Cl-]

Isomeric SMILES

CN(CCC#N)C1=CC=C(C=C1)C(=C2C=CC(=[NH+]C3=CC=CC=C3)C4=CC=CC=C24)C5=CC=C(C=C5)N(C)CCC#N.[Cl-]

InChI

InChI=1S/C37H33N5.ClH/c1-41(26-8-24-38)31-18-14-28(15-19-31)37(29-16-20-32(21-17-29)42(2)27-9-25-39)35-22-23-36(34-13-7-6-12-33(34)35)40-30-10-4-3-5-11-30;/h3-7,10-23H,8-9,26-27H2,1-2H3;1H