3-[cyclopropylcarbonyl-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl]amino]benzoic acid

Systemtic Name: 3-[cyclopropylcarbonyl-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl]amino]benzoic acid Openeye Name: 3-[cyclopropanecarbonyl-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl]amino]benzoic acid CAS Name: 3-[[cyclopropyl(oxo)methyl]-[(8-methoxy-2,2-dimethyl-1-benzopyran-7-yl)methyl]amino]benzoic acid IUPAC Name: 3-[cyclopropanecarbonyl-[(8-methoxy-2,2-dimethylchromen-7-yl)methyl]amino]benzoic acid Traditional Name: 3-[cyclopropanecarbonyl-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl]amino]benzoic acid Formula: C24H25NO5 MolecularWeight: 407.459

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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)O)C(=O)C4CC4)OC)C

Isomeric SMILES

CC1(C=CC2=C(O1)C(=C(C=C2)CN(C3=CC=CC(=C3)C(=O)O)C(=O)C4CC4)OC)C

InChI

InChI=1S/C24H25NO5/c1-24(2)12-11-15-7-10-18(20(29-3)21(15)30-24)14-25(22(26)16-8-9-16)19-6-4-5-17(13-19)23(27)28/h4-7,10-13,16H,8-9,14H2,1-3H3,(H,27,28)