2-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl-phenyl-carbamoyl]benzoic acid

Systemtic Name: 2-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl-phenyl-carbamoyl]benzoic acid Openeye Name: 2-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl-phenyl-carbamoyl]benzoic acid CAS Name: 2-[[N-[(8-methoxy-2,2-dimethyl-1-benzopyran-7-yl)methyl]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[(8-methoxy-2,2-dimethylchromen-7-yl)methyl-phenylcarbamoyl]benzoic acid Traditional Name: 2-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl-phenyl-carbamoyl]benzoic acid Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C(=C(C=C2)CN(C3=CC=CC=C3)C(=O)C4=CC=CC=C4C(=O)O)OC)C

Isomeric SMILES

CC1(C=CC2=C(O1)C(=C(C=C2)CN(C3=CC=CC=C3)C(=O)C4=CC=CC=C4C(=O)O)OC)C

InChI

InChI=1S/C27H25NO5/c1-27(2)16-15-18-13-14-19(23(32-3)24(18)33-27)17-28(20-9-5-4-6-10-20)25(29)21-11-7-8-12-22(21)26(30)31/h4-16H,17H2,1-3H3,(H,30,31)