methyl 3-[5-(5-chloranylindol-1-yl)pentyl]-5-(2-methoxy-2-oxidanylidene-ethyl)-4H-1,2-oxazole-5-carboxylate

Systemtic Name: methyl 3-[5-(5-chloranylindol-1-yl)pentyl]-5-(2-methoxy-2-oxidanylidene-ethyl)-4H-1,2-oxazole-5-carboxylate Openeye Name: methyl 3-[5-(5-chloroindol-1-yl)pentyl]-5-(2-methoxy-2-oxo-ethyl)-4H-isoxazole-5-carboxylate CAS Name: 3-[5-(5-chloro-1-indolyl)pentyl]-5-(2-methoxy-2-oxoethyl)-4H-isoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[5-(5-chloroindol-1-yl)pentyl]-5-(2-methoxy-2-oxoethyl)-4H-1,2-oxazole-5-carboxylate Traditional Name: 3-[5-(5-chloroindol-1-yl)pentyl]-5-(2-keto-2-methoxy-ethyl)-2-isoxazoline-5-carboxylic acid methyl ester Formula: C21H25ClN2O5 MolecularWeight: 420.8866

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(CC(=NO1)CCCCCN2C=CC3=C2C=CC(=C3)Cl)C(=O)OC

Isomeric SMILES

COC(=O)CC1(CC(=NO1)CCCCCN2C=CC3=C2C=CC(=C3)Cl)C(=O)OC

InChI

InChI=1S/C21H25ClN2O5/c1-27-19(25)14-21(20(26)28-2)13-17(23-29-21)6-4-3-5-10-24-11-9-15-12-16(22)7-8-18(15)24/h7-9,11-12H,3-6,10,13-14H2,1-2H3