tert-butyl N-[4-[[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamate CAS Name: N-[4-[[[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]carbamoyl]phenyl]carbamate Traditional Name: N-[4-[[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C25H34N3O4+ MolecularWeight: 440.55516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NCC(C2=CC(=CC=C2)OC)[NH+]3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC[C@@H](C2=CC(=CC=C2)OC)[NH+]3CCCC3

InChI

InChI=1S/C25H33N3O4/c1-25(2,3)32-24(30)27-20-12-10-18(11-13-20)23(29)26-17-22(28-14-5-6-15-28)19-8-7-9-21(16-19)31-4/h7-13,16,22H,5-6,14-15,17H2,1-4H3,(H,26,29)(H,27,30)/p+1/t22-/m0/s1