6-aminocarbonylnonan-4-yl-(3,4-dimethoxyphenyl)-methyl-phenyl-azanium

Systemtic Name: 6-aminocarbonylnonan-4-yl-(3,4-dimethoxyphenyl)-methyl-phenyl-azanium Openeye Name: (3-carbamoyl-1-propyl-hexyl)-(3,4-dimethoxyphenyl)-methyl-phenyl-ammonium CAS Name: 6-carbamoylnonan-4-yl-(3,4-dimethoxyphenyl)-methyl-phenylammonium IUPAC Name: 6-carbamoylnonan-4-yl-(3,4-dimethoxyphenyl)-methyl-phenylazanium Traditional Name: (3-carbamoyl-1-propyl-hexyl)-(3,4-dimethoxyphenyl)-methyl-phenyl-ammonium Formula: C25H37N2O3+ MolecularWeight: 413.57288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(CCC)[N+](C)(C1=CC=CC=C1)C2=CC(=C(C=C2)OC)OC)C(=O)N

Isomeric SMILES

CCCC(CC(CCC)[N+](C)(C1=CC=CC=C1)C2=CC(=C(C=C2)OC)OC)C(=O)N

InChI

InChI=1S/C25H36N2O3/c1-6-11-19(25(26)28)17-21(12-7-2)27(3,20-13-9-8-10-14-20)22-15-16-23(29-4)24(18-22)30-5/h8-10,13-16,18-19,21H,6-7,11-12,17H2,1-5H3,(H-,26,28)/p+1