[3-[3-ethoxycarbonyl-2-methyl-1-(4-methylphenyl)indol-5-yl]oxy-2-oxidanyl-propyl]-(1-phenylethyl)azanium

Systemtic Name: [3-[3-ethoxycarbonyl-2-methyl-1-(4-methylphenyl)indol-5-yl]oxy-2-oxidanyl-propyl]-(1-phenylethyl)azanium Openeye Name: [3-[3-ethoxycarbonyl-2-methyl-1-(p-tolyl)indol-5-yl]oxy-2-hydroxy-propyl]-(1-phenylethyl)ammonium CAS Name: [3-[[3-ethoxycarbonyl-2-methyl-1-(4-methylphenyl)-5-indolyl]oxy]-2-hydroxypropyl]-(1-phenylethyl)ammonium IUPAC Name: [3-[3-ethoxycarbonyl-2-methyl-1-(4-methylphenyl)indol-5-yl]oxy-2-hydroxypropyl]-(1-phenylethyl)azanium Traditional Name: [3-[3-carbethoxy-2-methyl-1-(p-tolyl)indol-5-yl]oxy-2-hydroxy-propyl]-(1-phenylethyl)ammonium Formula: C30H35N2O4+ MolecularWeight: 487.6099

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(C[NH2+]C(C)C3=CC=CC=C3)O)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(C[NH2+]C(C)C3=CC=CC=C3)O)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C30H34N2O4/c1-5-35-30(34)29-22(4)32(24-13-11-20(2)12-14-24)28-16-15-26(17-27(28)29)36-19-25(33)18-31-21(3)23-9-7-6-8-10-23/h6-17,21,25,31,33H,5,18-19H2,1-4H3/p+1