(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-benzamido-3-phenyl-propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-benzamido-3-phenyl-propanoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 2-benzamido-3-phenyl-propanoate CAS Name: 2-benzamido-3-phenylpropanoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 2-benzamido-3-phenylpropanoate Traditional Name: 2-benzamido-3-phenyl-propionic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C27H23NO5 MolecularWeight: 441.47522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H23NO5/c1-18-12-13-22-21(16-25(29)33-24(22)14-18)17-32-27(31)23(15-19-8-4-2-5-9-19)28-26(30)20-10-6-3-7-11-20/h2-14,16,23H,15,17H2,1H3,(H,28,30)