cyclohexyl-[(2R)-3-(3-ethanoyl-1-ethyl-2-methyl-indol-5-yl)oxy-2-oxidanyl-propyl]azanium

Systemtic Name: cyclohexyl-[(2R)-3-(3-ethanoyl-1-ethyl-2-methyl-indol-5-yl)oxy-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-3-(3-acetyl-1-ethyl-2-methyl-indol-5-yl)oxy-2-hydroxy-propyl]-cyclohexyl-ammonium CAS Name: [(2R)-3-[(3-acetyl-1-ethyl-2-methyl-5-indolyl)oxy]-2-hydroxypropyl]-cyclohexylammonium IUPAC Name: [(2R)-3-(3-acetyl-1-ethyl-2-methylindol-5-yl)oxy-2-hydroxypropyl]-cyclohexylazanium Traditional Name: [(2R)-3-(3-acetyl-1-ethyl-2-methyl-indol-5-yl)oxy-2-hydroxy-propyl]-cyclohexyl-ammonium Formula: C22H33N2O3+ MolecularWeight: 373.50902

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=C1C=CC(=C2)OCC(C[NH2+]C3CCCCC3)O)C(=O)C)C

Isomeric SMILES

CCN1C(=C(C2=C1C=CC(=C2)OC[C@@H](C[NH2+]C3CCCCC3)O)C(=O)C)C

InChI

InChI=1S/C22H32N2O3/c1-4-24-15(2)22(16(3)25)20-12-19(10-11-21(20)24)27-14-18(26)13-23-17-8-6-5-7-9-17/h10-12,17-18,23,26H,4-9,13-14H2,1-3H3/p+1/t18-/m1/s1