[4-[[[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[[3-ethoxy-4-(3-pyridylmethoxy)benzoyl]amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[[3-ethoxy-4-(3-pyridinylmethoxy)phenyl]-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[[3-ethoxy-4-(pyridin-3-ylmethoxy)benzoyl]amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[[3-ethoxy-4-(3-pyridylmethoxy)benzoyl]amino]methyl]benzyl]-diethyl-ammonium Formula: C27H34N3O3+ MolecularWeight: 448.57716

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OCC3=CN=CC=C3)OCC

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OCC3=CN=CC=C3)OCC

InChI

InChI=1S/C27H33N3O3/c1-4-30(5-2)19-22-11-9-21(10-12-22)18-29-27(31)24-13-14-25(26(16-24)32-6-3)33-20-23-8-7-15-28-17-23/h7-17H,4-6,18-20H2,1-3H3,(H,29,31)/p+1