ethyl 4-(3-imidazol-1-ylpropylcarbamoylamino)benzoate

Systemtic Name: ethyl 4-(3-imidazol-1-ylpropylcarbamoylamino)benzoate Openeye Name: ethyl 4-(3-imidazol-1-ylpropylcarbamoylamino)benzoate CAS Name: 4-[[[3-(1-imidazolyl)propylamino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-imidazol-1-ylpropylcarbamoylamino)benzoate Traditional Name: 4-(3-imidazol-1-ylpropylcarbamoylamino)benzoic acid ethyl ester Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCCCN2C=CN=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCCCN2C=CN=C2

InChI

InChI=1S/C16H20N4O3/c1-2-23-15(21)13-4-6-14(7-5-13)19-16(22)18-8-3-10-20-11-9-17-12-20/h4-7,9,11-12H,2-3,8,10H2,1H3,(H2,18,19,22)