N-(2-methoxy-5-methyl-phenyl)-3-oxidanyl-4-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]naphthalene-2-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-3-oxidanyl-4-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]naphthalene-2-carboxamide Openeye Name: 3-hydroxy-N-(2-methoxy-5-methyl-phenyl)-4-[[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]naphthalene-2-carboxamide CAS Name: 3-hydroxy-N-(2-methoxy-5-methylphenyl)-4-[[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-2-naphthalenecarboxamide IUPAC Name: 3-hydroxy-N-(2-methoxy-5-methylphenyl)-4-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]naphthalene-2-carboxamide Traditional Name: 3-hydroxy-N-(2-methoxy-5-methyl-phenyl)-4-[[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-2-naphthamide Formula: C28H29N2O3S+ MolecularWeight: 473.60646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=CC=CC=C3C(=C2O)C[NH+]4CCCC4C5=CC=CS5

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=CC=CC=C3C(=C2O)C[NH+]4CCC[C@H]4C5=CC=CS5

InChI

InChI=1S/C28H28N2O3S/c1-18-11-12-25(33-2)23(15-18)29-28(32)21-16-19-7-3-4-8-20(19)22(27(21)31)17-30-13-5-9-24(30)26-10-6-14-34-26/h3-4,6-8,10-12,14-16,24,31H,5,9,13,17H2,1-2H3,(H,29,32)/p+1/t24-/m0/s1