(2S)-2-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[2-(6-chloro-2-keto-7-methoxy-4-methyl-chromen-3-yl)acetyl]amino]-4-methyl-valerate Formula: C19H21ClNO6- MolecularWeight: 394.82614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)NC(CC(C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)N[C@@H](CC(C)C)C(=O)[O-]

InChI

InChI=1S/C19H22ClNO6/c1-9(2)5-14(18(23)24)21-17(22)7-12-10(3)11-6-13(20)16(26-4)8-15(11)27-19(12)25/h6,8-9,14H,5,7H2,1-4H3,(H,21,22)(H,23,24)/p-1/t14-/m0/s1