[5-[[(2S)-butan-2-yl]carbamoyl]furan-2-yl]methyl-cyclohexyl-[(2-methylphenyl)methyl]azanium

Systemtic Name: [5-[[(2S)-butan-2-yl]carbamoyl]furan-2-yl]methyl-cyclohexyl-[(2-methylphenyl)methyl]azanium Openeye Name: cyclohexyl-[[5-[[(1S)-1-methylpropyl]carbamoyl]-2-furyl]methyl]-(o-tolylmethyl)ammonium CAS Name: [5-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-furanyl]methyl-cyclohexyl-[(2-methylphenyl)methyl]ammonium IUPAC Name: [5-[[(2S)-butan-2-yl]carbamoyl]furan-2-yl]methyl-cyclohexyl-[(2-methylphenyl)methyl]azanium Traditional Name: cyclohexyl-(2-methylbenzyl)-[[5-[[(1S)-1-methylpropyl]carbamoyl]-2-furyl]methyl]ammonium Formula: C24H35N2O2+ MolecularWeight: 383.5469

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2C)C3CCCCC3

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2C)C3CCCCC3

InChI

InChI=1S/C24H34N2O2/c1-4-19(3)25-24(27)23-15-14-22(28-23)17-26(21-12-6-5-7-13-21)16-20-11-9-8-10-18(20)2/h8-11,14-15,19,21H,4-7,12-13,16-17H2,1-3H3,(H,25,27)/p+1/t19-/m0/s1