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

Systemtic Name: methyl 3-[5-(5-chloranyl-3-phenyl-indol-1-yl)pentyl]-5-(2-methoxy-2-oxidanylidene-ethyl)-4H-1,2-oxazole-5-carboxylate Openeye Name: methyl 3-[5-(5-chloro-3-phenyl-indol-1-yl)pentyl]-5-(2-methoxy-2-oxo-ethyl)-4H-isoxazole-5-carboxylate CAS Name: 3-[5-(5-chloro-3-phenyl-1-indolyl)pentyl]-5-(2-methoxy-2-oxoethyl)-4H-isoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[5-(5-chloro-3-phenylindol-1-yl)pentyl]-5-(2-methoxy-2-oxoethyl)-4H-1,2-oxazole-5-carboxylate Traditional Name: 3-[5-(5-chloro-3-phenyl-indol-1-yl)pentyl]-5-(2-keto-2-methoxy-ethyl)-2-isoxazoline-5-carboxylic acid methyl ester Formula: C27H29ClN2O5 MolecularWeight: 496.98256

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(CC(=NO1)CCCCCN2C=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)CC1(CC(=NO1)CCCCCN2C=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C27H29ClN2O5/c1-33-25(31)17-27(26(32)34-2)16-21(29-35-27)11-7-4-8-14-30-18-23(19-9-5-3-6-10-19)22-15-20(28)12-13-24(22)30/h3,5-6,9-10,12-13,15,18H,4,7-8,11,14,16-17H2,1-2H3