ethyl 5-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 5-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: ethyl 5-[[1-(imidazol-1-ylmethyl)-2-[(4-methoxyphenyl)methoxy]ethyl]amino]-5-oxo-pentanoate CAS Name: 5-[[1-(1-imidazolyl)-3-[(4-methoxyphenyl)methoxy]propan-2-yl]amino]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[1-(imidazol-1-ylmethyl)-2-p-anisyloxy-ethyl]amino]-5-keto-valeric acid ethyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(=O)NC(CN1C=CN=C1)COCC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)CCCC(=O)NC(CN1C=CN=C1)COCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H29N3O5/c1-3-29-21(26)6-4-5-20(25)23-18(13-24-12-11-22-16-24)15-28-14-17-7-9-19(27-2)10-8-17/h7-12,16,18H,3-6,13-15H2,1-2H3,(H,23,25)