propyl 4-[[3-(2-methylimidazol-1-yl)propylamino]methyl]benzoate

Systemtic Name: propyl 4-[[3-(2-methylimidazol-1-yl)propylamino]methyl]benzoate Openeye Name: propyl 4-[[3-(2-methylimidazol-1-yl)propylamino]methyl]benzoate CAS Name: 4-[[3-(2-methyl-1-imidazolyl)propylamino]methyl]benzoic acid propyl ester IUPAC Name: propyl 4-[[3-(2-methylimidazol-1-yl)propylamino]methyl]benzoate Traditional Name: 4-[[3-(2-methylimidazol-1-yl)propylamino]methyl]benzoic acid propyl ester Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)CNCCCN2C=CN=C2C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)CNCCCN2C=CN=C2C

InChI

InChI=1S/C18H25N3O2/c1-3-13-23-18(22)17-7-5-16(6-8-17)14-19-9-4-11-21-12-10-20-15(21)2/h5-8,10,12,19H,3-4,9,11,13-14H2,1-2H3