(2R)-5-(aminocarbonylamino)-2-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]pentanoic acid

Systemtic Name: (2R)-5-(aminocarbonylamino)-2-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]pentanoic acid Openeye Name: (2R)-2-[3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]-5-ureido-pentanoic acid CAS Name: (2R)-5-(carbamoylamino)-2-[[3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]pentanoic acid IUPAC Name: (2R)-5-(carbamoylamino)-2-[3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoylamino]pentanoic acid Traditional Name: (2R)-2-[3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propanoylamino]-5-ureido-valeric acid Formula: C20H25N3O7 MolecularWeight: 419.4284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC(CCCNC(=O)N)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N[C@H](CCCNC(=O)N)C(=O)O

InChI

InChI=1S/C20H25N3O7/c1-11-13-6-5-12(29-2)10-16(13)30-19(27)14(11)7-8-17(24)23-15(18(25)26)4-3-9-22-20(21)28/h5-6,10,15H,3-4,7-9H2,1-2H3,(H,23,24)(H,25,26)(H3,21,22,28)/t15-/m1/s1