[3-ethoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methyl-[2-(1H-indol-3-yl)ethyl]azanium

Systemtic Name: [3-ethoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methyl-[2-(1H-indol-3-yl)ethyl]azanium Openeye Name: [3-ethoxy-4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]methyl-[2-(1H-indol-3-yl)ethyl]ammonium CAS Name: [3-ethoxy-4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]methyl-[2-(1H-indol-3-yl)ethyl]ammonium IUPAC Name: [3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methyl-[2-(1H-indol-3-yl)ethyl]azanium Traditional Name: [3-ethoxy-4-(2-keto-2-piperidino-ethoxy)benzyl]-[2-(1H-indol-3-yl)ethyl]ammonium Formula: C26H34N3O3+ MolecularWeight: 436.56646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCC2=CNC3=CC=CC=C32)OCC(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCC2=CNC3=CC=CC=C32)OCC(=O)N4CCCCC4

InChI

InChI=1S/C26H33N3O3/c1-2-31-25-16-20(10-11-24(25)32-19-26(30)29-14-6-3-7-15-29)17-27-13-12-21-18-28-23-9-5-4-8-22(21)23/h4-5,8-11,16,18,27-28H,2-3,6-7,12-15,17,19H2,1H3/p+1