4-[[[(2S)-2-(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[[(2S)-2-(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[(2S)-2-(7-methyl-2-oxo-4-propyl-chromen-5-yl)oxypropanoyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[(2S)-2-[(7-methyl-2-oxo-4-propyl-1-benzopyran-5-yl)oxy]-1-oxopropyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[(2S)-2-(7-methyl-2-oxo-4-propylchromen-5-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[(2S)-2-(2-keto-7-methyl-4-propyl-chromen-5-yl)oxypropanoyl]amino]methyl]cyclohexanecarboxylate Formula: C24H30NO6- MolecularWeight: 428.4981

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)NCC3CCC(CC3)C(=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)O[C@@H](C)C(=O)NCC3CCC(CC3)C(=O)[O-]

InChI

InChI=1S/C24H31NO6/c1-4-5-18-12-21(26)31-20-11-14(2)10-19(22(18)20)30-15(3)23(27)25-13-16-6-8-17(9-7-16)24(28)29/h10-12,15-17H,4-9,13H2,1-3H3,(H,25,27)(H,28,29)/p-1/t15-,16?,17?/m0/s1