octan-2-yl 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate

Systemtic Name: octan-2-yl 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate Openeye Name: 1-methylheptyl 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate CAS Name: 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate Traditional Name: 4-(2-imidazolin-2-ylamino)benzoic acid 1-methylheptyl ester Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)NC2=NCCN2

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)NC2=NCCN2

InChI

InChI=1S/C18H27N3O2/c1-3-4-5-6-7-14(2)23-17(22)15-8-10-16(11-9-15)21-18-19-12-13-20-18/h8-11,14H,3-7,12-13H2,1-2H3,(H2,19,20,21)