cyclohexylmethyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-[(2R)-2-oxidanylpropyl]azanium

Systemtic Name: cyclohexylmethyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-[(2R)-2-oxidanylpropyl]azanium Openeye Name: cyclohexylmethyl-[(2R)-2-hydroxypropyl]-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]ammonium CAS Name: cyclohexylmethyl-[(2R)-2-hydroxypropyl]-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]ammonium IUPAC Name: cyclohexylmethyl-[(2R)-2-hydroxypropyl]-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]azanium Traditional Name: cyclohexylmethyl-[(2R)-2-hydroxypropyl]-[(1-m-anisylpyrrol-2-yl)methyl]ammonium Formula: C23H35N2O2+ MolecularWeight: 371.5362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](CC1CCCCC1)CC2=CC=CN2CC3=CC(=CC=C3)OC)O

Isomeric SMILES

C[C@H](C[NH+](CC1CCCCC1)CC2=CC=CN2CC3=CC(=CC=C3)OC)O

InChI

InChI=1S/C23H34N2O2/c1-19(26)15-24(16-20-8-4-3-5-9-20)18-22-11-7-13-25(22)17-21-10-6-12-23(14-21)27-2/h6-7,10-14,19-20,26H,3-5,8-9,15-18H2,1-2H3/p+1/t19-/m1/s1