tert-butyl N-[4-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylcarbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylcarbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylcarbamoyl]phenyl]carbamate CAS Name: N-[4-[[[2-(4-morpholin-4-iumylmethyl)phenyl]methylamino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylcarbamoyl]phenyl]carbamate Traditional Name: N-[4-[[2-(morpholin-4-ium-4-ylmethyl)benzyl]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C24H32N3O4+ MolecularWeight: 426.52858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3

InChI

InChI=1S/C24H31N3O4/c1-24(2,3)31-23(29)26-21-10-8-18(9-11-21)22(28)25-16-19-6-4-5-7-20(19)17-27-12-14-30-15-13-27/h4-11H,12-17H2,1-3H3,(H,25,28)(H,26,29)/p+1