N-[5-[[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[5-[[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-[[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[[[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-oxomethyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-[[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]carbamoyl]-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-[[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-2-methyl-phenyl]-2-furamide Formula: C26H30N3O4+ MolecularWeight: 448.5341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)OC)[NH+]3CCCC3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC[C@H](C2=CC=C(C=C2)OC)[NH+]3CCCC3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C26H29N3O4/c1-18-7-8-20(16-22(18)28-26(31)24-6-5-15-33-24)25(30)27-17-23(29-13-3-4-14-29)19-9-11-21(32-2)12-10-19/h5-12,15-16,23H,3-4,13-14,17H2,1-2H3,(H,27,30)(H,28,31)/p+1/t23-/m1/s1