4-[[[(2S)-2-(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[[(2S)-2-(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[(2S)-2-(6-chloro-2-oxo-4-phenyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[(2S)-2-[(6-chloro-2-oxo-4-phenyl-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[(2S)-2-(6-chloro-2-oxo-4-phenylchromen-7-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[(2S)-2-(6-chloro-2-keto-4-phenyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexanecarboxylate Formula: C26H25ClNO6- MolecularWeight: 482.9328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCC(CC1)C(=O)[O-])OC2=C(C=C3C(=CC(=O)OC3=C2)C4=CC=CC=C4)Cl

Isomeric SMILES

C[C@@H](C(=O)NCC1CCC(CC1)C(=O)[O-])OC2=C(C=C3C(=CC(=O)OC3=C2)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H26ClNO6/c1-15(25(30)28-14-16-7-9-18(10-8-16)26(31)32)33-23-13-22-20(11-21(23)27)19(12-24(29)34-22)17-5-3-2-4-6-17/h2-6,11-13,15-16,18H,7-10,14H2,1H3,(H,28,30)(H,31,32)/p-1/t15-,16?,18?/m0/s1