ethyl N-[4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylcarbamoyl]phenyl]carbamate

Systemtic Name: ethyl N-[4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylcarbamoyl]phenyl]carbamate Openeye Name: ethyl N-[4-[(6-morpholinopyridin-1-ium-3-yl)methylcarbamoyl]phenyl]carbamate CAS Name: N-[4-[[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methylamino]-oxomethyl]phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylcarbamoyl]phenyl]carbamate Traditional Name: N-[4-[(6-morpholinopyridin-1-ium-3-yl)methylcarbamoyl]phenyl]carbamic acid ethyl ester Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=C(C=C1)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

CCOC(=O)NC1=CC=C(C=C1)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H24N4O4/c1-2-28-20(26)23-17-6-4-16(5-7-17)19(25)22-14-15-3-8-18(21-13-15)24-9-11-27-12-10-24/h3-8,13H,2,9-12,14H2,1H3,(H,22,25)(H,23,26)/p+1