cyclopropyl-[(2-methoxycarbonylphenyl)methyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]azanium

Systemtic Name: cyclopropyl-[(2-methoxycarbonylphenyl)methyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]azanium Openeye Name: (1-benzylpyrrol-2-yl)methyl-cyclopropyl-[(2-methoxycarbonylphenyl)methyl]ammonium CAS Name: cyclopropyl-[(2-methoxycarbonylphenyl)methyl]-[[1-(phenylmethyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: (1-benzylpyrrol-2-yl)methyl-cyclopropyl-[(2-methoxycarbonylphenyl)methyl]azanium Traditional Name: (1-benzylpyrrol-2-yl)methyl-(2-carbomethoxybenzyl)-cyclopropyl-ammonium Formula: C24H27N2O2+ MolecularWeight: 375.48338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C[NH+](CC2=CC=CN2CC3=CC=CC=C3)C4CC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1C[NH+](CC2=CC=CN2CC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C24H26N2O2/c1-28-24(27)23-12-6-5-10-20(23)17-26(21-13-14-21)18-22-11-7-15-25(22)16-19-8-3-2-4-9-19/h2-12,15,21H,13-14,16-18H2,1H3/p+1