4-[4-oxidanylidene-7-(2-piperidin-1-ylethanoylamino)chromen-2-yl]benzoic acid

Systemtic Name: 4-[4-oxidanylidene-7-(2-piperidin-1-ylethanoylamino)chromen-2-yl]benzoic acid Openeye Name: 4-[4-oxo-7-[[2-(1-piperidyl)acetyl]amino]chromen-2-yl]benzoic acid CAS Name: 4-[4-oxo-7-[[1-oxo-2-(1-piperidinyl)ethyl]amino]-1-benzopyran-2-yl]benzoic acid IUPAC Name: 4-[4-oxo-7-[(2-piperidin-1-ylacetyl)amino]chromen-2-yl]benzoic acid Traditional Name: 4-[4-keto-7-[(2-piperidinoacetyl)amino]chromen-2-yl]benzoic acid Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(=O)NC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)CC(=O)NC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H22N2O5/c26-19-13-20(15-4-6-16(7-5-15)23(28)29)30-21-12-17(8-9-18(19)21)24-22(27)14-25-10-2-1-3-11-25/h4-9,12-13H,1-3,10-11,14H2,(H,24,27)(H,28,29)