(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(phenylcarbamoylamino)propanoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(phenylcarbamoylamino)propanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 3-(phenylcarbamoylamino)propanoate CAS Name: 3-[[anilino(oxo)methyl]amino]propanoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 3-(phenylcarbamoylamino)propanoate Traditional Name: 3-(phenylcarbamoylamino)propionic acid (6-chloro-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=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCNC(=O)NC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCNC(=O)NC3=CC=CC=C3)Cl

InChI

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