ethyl 3-[4-(4-aminocarbonylimidazol-1-yl)-4-oxidanyl-butyl]benzoate

Systemtic Name: ethyl 3-[4-(4-aminocarbonylimidazol-1-yl)-4-oxidanyl-butyl]benzoate Openeye Name: ethyl 3-[4-(4-carbamoylimidazol-1-yl)-4-hydroxy-butyl]benzoate CAS Name: 3-[4-(4-carbamoyl-1-imidazolyl)-4-hydroxybutyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[4-(4-carbamoylimidazol-1-yl)-4-hydroxybutyl]benzoate Traditional Name: 3-[4-(4-carbamoylimidazol-1-yl)-4-hydroxy-butyl]benzoic acid ethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)CCCC(N2C=C(N=C2)C(=O)N)O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)CCCC(N2C=C(N=C2)C(=O)N)O

InChI

InChI=1S/C17H21N3O4/c1-2-24-17(23)13-7-3-5-12(9-13)6-4-8-15(21)20-10-14(16(18)22)19-11-20/h3,5,7,9-11,15,21H,2,4,6,8H2,1H3,(H2,18,22)