dicyclohexyl-[(2S)-2-oxidanyl-3-(2,3,5-trimethylindol-1-yl)propyl]azanium

Systemtic Name: dicyclohexyl-[(2S)-2-oxidanyl-3-(2,3,5-trimethylindol-1-yl)propyl]azanium Openeye Name: dicyclohexyl-[(2S)-2-hydroxy-3-(2,3,5-trimethylindol-1-yl)propyl]ammonium CAS Name: dicyclohexyl-[(2S)-2-hydroxy-3-(2,3,5-trimethyl-1-indolyl)propyl]ammonium IUPAC Name: dicyclohexyl-[(2S)-2-hydroxy-3-(2,3,5-trimethylindol-1-yl)propyl]azanium Traditional Name: dicyclohexyl-[(2S)-2-hydroxy-3-(2,3,5-trimethylindol-1-yl)propyl]ammonium Formula: C26H41N2O+ MolecularWeight: 397.61654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C)C)CC(C[NH+](C3CCCCC3)C4CCCCC4)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C)C)C[C@@H](C[NH+](C3CCCCC3)C4CCCCC4)O

InChI

InChI=1S/C26H40N2O/c1-19-14-15-26-25(16-19)20(2)21(3)27(26)17-24(29)18-28(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h14-16,22-24,29H,4-13,17-18H2,1-3H3/p+1/t24-/m0/s1