propan-2-yl (2R,3S)-3-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-4-cyclohexyl-2-oxidanyl-butanoate

Systemtic Name: propan-2-yl (2R,3S)-3-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-4-cyclohexyl-2-oxidanyl-butanoate Openeye Name: isopropyl (2R,3S)-3-[(5-chloro-1H-indole-2-carbonyl)amino]-4-cyclohexyl-2-hydroxy-butanoate CAS Name: (2R,3S)-3-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-4-cyclohexyl-2-hydroxybutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2R,3S)-3-[(5-chloro-1H-indole-2-carbonyl)amino]-4-cyclohexyl-2-hydroxybutanoate Traditional Name: (2R,3S)-3-[(5-chloro-1H-indole-2-carbonyl)amino]-4-cyclohexyl-2-hydroxy-butyric acid isopropyl ester Formula: C22H29ClN2O4 MolecularWeight: 420.92966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C(CC1CCCCC1)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl)O

Isomeric SMILES

CC(C)OC(=O)[C@@H]([C@H](CC1CCCCC1)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl)O

InChI

InChI=1S/C22H29ClN2O4/c1-13(2)29-22(28)20(26)18(10-14-6-4-3-5-7-14)25-21(27)19-12-15-11-16(23)8-9-17(15)24-19/h8-9,11-14,18,20,24,26H,3-7,10H2,1-2H3,(H,25,27)/t18-,20+/m0/s1