[4-[bis(4-dimethylaminophenyl)methylidene]naphthalen-1-ylidene]-phenyl-azanium; (Z)-octadec-9-enoate

Systemtic Name: [4-[bis(4-dimethylaminophenyl)methylidene]naphthalen-1-ylidene]-phenyl-azanium; (Z)-octadec-9-enoate Openeye Name: [4-[bis(4-dimethylaminophenyl)methylene]-1-naphthylidene]-phenyl-ammonium; (Z)-octadec-9-enoate CAS Name: [4-[bis(4-dimethylaminophenyl)methylidene]-1-naphthalenylidene]-phenylammonium; (Z)-9-octadecenoate IUPAC Name: [4-[bis(4-dimethylaminophenyl)methylidene]naphthalen-1-ylidene]-phenylazanium; (Z)-octadec-9-enoate Traditional Name: [4-[bis(4-dimethylaminophenyl)methylene]-1-naphthylidene]-phenyl-ammonium; (Z)-octadec-9-enoate Formula: C51H65N3O2 MolecularWeight: 752.0807

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)[O-].CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[NH+]C3=CC=CC=C3)C4=CC=CC=C24)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)[O-].CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[NH+]C3=CC=CC=C3)C4=CC=CC=C24)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C33H31N3.C18H34O2/c1-35(2)27-18-14-24(15-19-27)33(25-16-20-28(21-17-25)36(3)4)31-22-23-32(30-13-9-8-12-29(30)31)34-26-10-6-5-7-11-26;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-23H,1-4H3;9-10H,2-8,11-17H2,1H3,(H,19,20)/b;10-9-