ethyl 2-[[5-chloranyl-4-[5-(methylamino)pentyl]-2-oxidanyl-phenyl]carbonylamino]-3-cyclohexyl-propanoate

Systemtic Name: ethyl 2-[[5-chloranyl-4-[5-(methylamino)pentyl]-2-oxidanyl-phenyl]carbonylamino]-3-cyclohexyl-propanoate Openeye Name: ethyl 2-[[5-chloro-2-hydroxy-4-[5-(methylamino)pentyl]benzoyl]amino]-3-cyclohexyl-propanoate CAS Name: 2-[[[5-chloro-2-hydroxy-4-[5-(methylamino)pentyl]phenyl]-oxomethyl]amino]-3-cyclohexylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[5-chloro-2-hydroxy-4-[5-(methylamino)pentyl]benzoyl]amino]-3-cyclohexylpropanoate Traditional Name: 2-[[5-chloro-2-hydroxy-4-[5-(methylamino)pentyl]benzoyl]amino]-3-cyclohexyl-propionic acid ethyl ester Formula: C24H37ClN2O4 MolecularWeight: 453.01458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1CCCCC1)NC(=O)C2=CC(=C(C=C2O)CCCCCNC)Cl

Isomeric SMILES

CCOC(=O)C(CC1CCCCC1)NC(=O)C2=CC(=C(C=C2O)CCCCCNC)Cl

InChI

InChI=1S/C24H37ClN2O4/c1-3-31-24(30)21(14-17-10-6-4-7-11-17)27-23(29)19-16-20(25)18(15-22(19)28)12-8-5-9-13-26-2/h15-17,21,26,28H,3-14H2,1-2H3,(H,27,29)