(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C25H23NO6S MolecularWeight: 465.51822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C25H23NO6S/c1-16-11-22-20(14-25(28)32-23(22)12-17(16)2)15-31-24(27)9-10-26-33(29,30)21-8-7-18-5-3-4-6-19(18)13-21/h3-8,11-14,26H,9-10,15H2,1-2H3