(3R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: (3R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: (3R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]chromane-3-carboxamide CAS Name: (3R)-N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: (3R)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]chroman-3-carboxamide Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)C2CC3=CC=CC=C3OC2)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC=C1[C@H](CNC(=O)[C@@H]2CC3=CC=CC=C3OC2)[NH+]4CCCC4

InChI

InChI=1S/C23H28N2O3/c1-27-22-11-5-3-9-19(22)20(25-12-6-7-13-25)15-24-23(26)18-14-17-8-2-4-10-21(17)28-16-18/h2-5,8-11,18,20H,6-7,12-16H2,1H3,(H,24,26)/p+1/t18-,20+/m1/s1