(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(aminocarbonylamino)-3-(4-chlorophenyl)propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(aminocarbonylamino)-3-(4-chlorophenyl)propanoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 3-(4-chlorophenyl)-3-ureido-propanoate CAS Name: 3-(carbamoylamino)-3-(4-chlorophenyl)propanoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 3-(carbamoylamino)-3-(4-chlorophenyl)propanoate Traditional Name: 3-(4-chlorophenyl)-3-ureido-propionic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H19ClN2O5 MolecularWeight: 414.83896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CC(C3=CC=C(C=C3)Cl)NC(=O)N

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CC(C3=CC=C(C=C3)Cl)NC(=O)N

InChI

InChI=1S/C21H19ClN2O5/c1-12-2-7-16-14(9-20(26)29-18(16)8-12)11-28-19(25)10-17(24-21(23)27)13-3-5-15(22)6-4-13/h2-9,17H,10-11H2,1H3,(H3,23,24,27)