(2S)-2-[[(2S)-2-(8-methyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxypropanoyl]amino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[(2S)-2-(8-methyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxypropanoyl]amino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[(2S)-2-(8-methyl-2-oxo-4-propyl-chromen-7-yl)oxypropanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2S)-2-[(8-methyl-2-oxo-4-propyl-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[(2S)-2-(8-methyl-2-oxo-4-propylchromen-7-yl)oxypropanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S)-2-(2-keto-8-methyl-4-propyl-chromen-7-yl)oxypropanoyl]amino]-3-phenyl-propionate Formula: C25H26NO6- MolecularWeight: 436.47704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2C)O[C@@H](C)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C25H27NO6/c1-4-8-18-14-22(27)32-23-15(2)21(12-11-19(18)23)31-16(3)24(28)26-20(25(29)30)13-17-9-6-5-7-10-17/h5-7,9-12,14,16,20H,4,8,13H2,1-3H3,(H,26,28)(H,29,30)/p-1/t16-,20-/m0/s1