methyl 3-[1-[3-[2-(butylcarbamoylamino)-3-methyl-phenoxy]propyl]imidazol-4-yl]propanoate

Systemtic Name: methyl 3-[1-[3-[2-(butylcarbamoylamino)-3-methyl-phenoxy]propyl]imidazol-4-yl]propanoate Openeye Name: methyl 3-[1-[3-[2-(butylcarbamoylamino)-3-methyl-phenoxy]propyl]imidazol-4-yl]propanoate CAS Name: 3-[1-[3-[2-[[butylamino(oxo)methyl]amino]-3-methylphenoxy]propyl]-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[3-[2-(butylcarbamoylamino)-3-methylphenoxy]propyl]imidazol-4-yl]propanoate Traditional Name: 3-[1-[3-[2-(butylcarbamoylamino)-3-methyl-phenoxy]propyl]imidazol-4-yl]propionic acid methyl ester Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C(C=CC=C1OCCCN2C=C(N=C2)CCC(=O)OC)C

Isomeric SMILES

CCCCNC(=O)NC1=C(C=CC=C1OCCCN2C=C(N=C2)CCC(=O)OC)C

InChI

InChI=1S/C22H32N4O4/c1-4-5-12-23-22(28)25-21-17(2)8-6-9-19(21)30-14-7-13-26-15-18(24-16-26)10-11-20(27)29-3/h6,8-9,15-16H,4-5,7,10-14H2,1-3H3,(H2,23,25,28)