phenyl-[N-phenyl-C-[1-[phenyl(tridecanoyl)amino]propan-2-yl]carbonimidoyl]azanium

Systemtic Name: phenyl-[N-phenyl-C-[1-[phenyl(tridecanoyl)amino]propan-2-yl]carbonimidoyl]azanium Openeye Name: [C-[1-methyl-2-(N-tridecanoylanilino)ethyl]-N-phenyl-carbonimidoyl]-phenyl-ammonium CAS Name: [2-methyl-3-[N-(1-oxotridecyl)anilino]-1-phenyliminopropyl]-phenylammonium IUPAC Name: phenyl-[N-phenyl-C-[1-(N-tridecanoylanilino)propan-2-yl]carbonimidoyl]azanium Traditional Name: [C-[1-methyl-2-(N-tridecanoylanilino)ethyl]-N-phenyl-carbonimidoyl]-phenyl-ammonium Formula: C35H48N3O+ MolecularWeight: 526.77512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)N(CC(C)C(=NC1=CC=CC=C1)[NH2+]C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCC(=O)N(CC(C)C(=NC1=CC=CC=C1)[NH2+]C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C35H47N3O/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)/p+1