hexyl 4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoate

Systemtic Name: hexyl 4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoate Openeye Name: hexyl 4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoate CAS Name: 4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid hexyl ester IUPAC Name: hexyl 4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoate Traditional Name: 4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid hexyl ester Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC2=NCCCN2

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC2=NCCCN2

InChI

InChI=1S/C17H25N3O2/c1-2-3-4-5-13-22-16(21)14-7-9-15(10-8-14)20-17-18-11-6-12-19-17/h7-10H,2-6,11-13H2,1H3,(H2,18,19,20)