(2S)-2-[[(2R)-2-(3-hexyl-4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]propanoate

Systemtic Name: (2S)-2-[[(2R)-2-(3-hexyl-4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]propanoate Openeye Name: (2S)-2-[[(2R)-2-(3-hexyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]propanoate CAS Name: (2S)-2-[[(2R)-2-[(3-hexyl-4,8-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]propanoate IUPAC Name: (2S)-2-[[(2R)-2-(3-hexyl-4,8-dimethyl-2-oxochromen-7-yl)oxypropanoyl]amino]propanoate Traditional Name: (2S)-2-[[(2R)-2-(3-hexyl-2-keto-4,8-dimethyl-chromen-7-yl)oxypropanoyl]amino]propionate Formula: C23H30NO6- MolecularWeight: 416.4874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C(=C(C=C2)OC(C)C(=O)NC(C)C(=O)[O-])C)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C(=C(C=C2)O[C@H](C)C(=O)N[C@@H](C)C(=O)[O-])C)OC1=O)C

InChI

InChI=1S/C23H31NO6/c1-6-7-8-9-10-18-13(2)17-11-12-19(14(3)20(17)30-23(18)28)29-16(5)21(25)24-15(4)22(26)27/h11-12,15-16H,6-10H2,1-5H3,(H,24,25)(H,26,27)/p-1/t15-,16+/m0/s1