N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(3-methylphenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(3-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(m-tolylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-[(3-methylphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-4-[(3-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(3-methylbenzyl)piperazin-4-ium-1-carboxamide Formula: C23H34N4O2+2 MolecularWeight: 398.54166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)NCC(C3=CC=CO3)[NH+]4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)NC[C@H](C3=CC=CO3)[NH+]4CCCC4

InChI

InChI=1S/C23H32N4O2/c1-19-6-4-7-20(16-19)18-25-11-13-27(14-12-25)23(28)24-17-21(22-8-5-15-29-22)26-9-2-3-10-26/h4-8,15-16,21H,2-3,9-14,17-18H2,1H3,(H,24,28)/p+2/t21-/m1/s1