(2S)-5-(aminocarbonylamino)-2-[3-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]pentanoate

Systemtic Name: (2S)-5-(aminocarbonylamino)-2-[3-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]pentanoate Openeye Name: (2S)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoylamino]-5-ureido-pentanoate CAS Name: (2S)-5-(carbamoylamino)-2-[[3-(7-hydroxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]pentanoate IUPAC Name: (2S)-5-(carbamoylamino)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]pentanoate Traditional Name: (2S)-2-[3-(7-hydroxy-2-keto-4,8-dimethyl-chromen-3-yl)propanoylamino]-5-ureido-valerate Formula: C20H24N3O7- MolecularWeight: 418.42046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)NC(CCCNC(=O)N)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)N[C@@H](CCCNC(=O)N)C(=O)[O-]

InChI

InChI=1S/C20H25N3O7/c1-10-12-5-7-15(24)11(2)17(12)30-19(28)13(10)6-8-16(25)23-14(18(26)27)4-3-9-22-20(21)29/h5,7,14,24H,3-4,6,8-9H2,1-2H3,(H,23,25)(H,26,27)(H3,21,22,29)/p-1/t14-/m0/s1