N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(2-methylphenoxy)butanamide

Systemtic Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(2-methylphenoxy)butanamide Openeye Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(2-methylphenoxy)butanamide CAS Name: N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(2-methylphenoxy)butanamide IUPAC Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-(2-methylphenoxy)butanamide Traditional Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(2-methylphenoxy)butyramide Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC(=O)NCC(C2=CC(=CC=C2)OC)[NH+]3CCCC3

Isomeric SMILES

CC1=CC=CC=C1OCCCC(=O)NC[C@@H](C2=CC(=CC=C2)OC)[NH+]3CCCC3

InChI

InChI=1S/C24H32N2O3/c1-19-9-3-4-12-23(19)29-16-8-13-24(27)25-18-22(26-14-5-6-15-26)20-10-7-11-21(17-20)28-2/h3-4,7,9-12,17,22H,5-6,8,13-16,18H2,1-2H3,(H,25,27)/p+1/t22-/m0/s1