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[1-[2-(2-oxidanylidene-3-propan-2-yl-imidazol-1-yl)ethyl]piperidin-4-yl]methyl 4-azanyl-5-chloranyl-2,3-dihydro-1-benzofuran-7-carboxylate

[1-[2-(2-oxidanylidene-3-propan-2-yl-imidazol-1-yl)ethyl]piperidin-4-yl]methyl 4-azanyl-5-chloranyl-2,3-dihydro-1-benzofuran-7-carboxylate

Systemtic Name:[1-[2-(2-oxidanylidene-3-propan-2-yl-imidazol-1-yl)ethyl]piperidin-4-yl]methyl 4-azanyl-5-chloranyl-2,3-dihydro-1-benzofuran-7-carboxylate
Openeye Name:[1-[2-(3-isopropyl-2-oxo-imidazol-1-yl)ethyl]-4-piperidyl]methyl 4-amino-5-chloro-2,3-dihydrobenzofuran-7-carboxylate
CAS Name:4-amino-5-chloro-2,3-dihydrobenzofuran-7-carboxylic acid [1-[2-(2-oxo-3-propan-2-yl-1-imidazolyl)ethyl]-4-piperidinyl]methyl ester
IUPAC Name:[1-[2-(2-oxo-3-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-yl]methyl 4-amino-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylate
Traditional Name:4-amino-5-chloro-coumaran-7-carboxylic acid [1-[2-(3-isopropyl-2-keto-4-imidazolin-1-yl)ethyl]-4-piperidyl]methyl ester
Formula: C23H31ClN4O4
MolecularWeight: 462.96964
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CN(C1=O)CCN2CCC(CC2)COC(=O)C3=CC(=C(C4=C3OCC4)N)Cl


Isomeric SMILES

CC(C)N1C=CN(C1=O)CCN2CCC(CC2)COC(=O)C3=CC(=C(C4=C3OCC4)N)Cl


InChI

InChI=1S/C23H31ClN4O4/c1-15(2)28-11-10-27(23(28)30)9-8-26-6-3-16(4-7-26)14-32-22(29)18-13-19(24)20(25)17-5-12-31-21(17)18/h10-11,13,15-16H,3-9,12,14,25H2,1-2H3


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