ethyl 4-[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-(morpholin-4-ium-4-ylmethyl)benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-(4-morpholin-4-iumylmethyl)phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(morpholin-4-ium-4-ylmethyl)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-(morpholin-4-ium-4-ylmethyl)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H28N3O4+ MolecularWeight: 362.44332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C19H27N3O4/c1-2-26-19(24)22-9-7-21(8-10-22)18(23)17-5-3-16(4-6-17)15-20-11-13-25-14-12-20/h3-6H,2,7-15H2,1H3/p+1