[2-methyl-1-phenylazanyl-3-[phenyl(tridecanoyl)amino]propylidene]-phenyl-azanium chloride

Systemtic Name: [2-methyl-1-phenylazanyl-3-[phenyl(tridecanoyl)amino]propylidene]-phenyl-azanium chloride Openeye Name: [1-anilino-2-methyl-3-(N-tridecanoylanilino)propylidene]-phenyl-ammonium chloride CAS Name: [1-anilino-2-methyl-3-[N-(1-oxotridecyl)anilino]propylidene]-phenylammonium chloride IUPAC Name: [1-anilino-2-methyl-3-(N-tridecanoylanilino)propylidene]-phenylazanium chloride Traditional Name: [1-anilino-2-methyl-3-(N-tridecanoylanilino)propylidene]-phenyl-ammonium chloride Formula: C35H48ClN3O MolecularWeight: 562.22812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)N(CC(C)C(=[NH+]C1=CC=CC=C1)NC2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC(=O)N(CC(C)C(=[NH+]C1=CC=CC=C1)NC2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C35H47N3O.ClH/c1-3-4-5-6-7-8-9-10-11-21-28-34(39)38(33-26-19-14-20-27-33)29-30(2)35(36-31-22-15-12-16-23-31)37-32-24-17-13-18-25-32;/h12-20,22-27,30H,3-11,21,28-29H2,1-2H3,(H,36,37);1H