tert-butyl N-[4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]carbamate

Systemtic Name: tert-butyl N-[4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]carbamate Openeye Name: tert-butyl N-[4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]carbamate CAS Name: N-[4-[[3-(4-morpholin-4-iumyl)propylamino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]carbamate Traditional Name: N-[4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]carbamic acid tert-butyl ester Formula: C19H30N3O4+ MolecularWeight: 364.4592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C19H29N3O4/c1-19(2,3)26-18(24)21-16-7-5-15(6-8-16)17(23)20-9-4-10-22-11-13-25-14-12-22/h5-8H,4,9-14H2,1-3H3,(H,20,23)(H,21,24)/p+1