2-[1-[4-(2,3-dihydro-1H-inden-2-ylcarbonylamino)phenyl]carbonylisoquinolin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[4-(2,3-dihydro-1H-inden-2-ylcarbonylamino)phenyl]carbonylisoquinolin-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(indane-2-carbonylamino)benzoyl]-4-isoquinolyl]acetic acid CAS Name: 2-[1-[[4-[[2,3-dihydro-1H-inden-2-yl(oxo)methyl]amino]phenyl]-oxomethyl]-4-isoquinolinyl]acetic acid IUPAC Name: 2-[1-[4-(2,3-dihydro-1H-indene-2-carbonylamino)benzoyl]isoquinolin-4-yl]acetic acid Traditional Name: 2-[1-[4-(indane-2-carbonylamino)benzoyl]-4-isoquinolyl]acetic acid Formula: C28H22N2O4 MolecularWeight: 450.48528

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)C(=O)C4=NC=C(C5=CC=CC=C54)CC(=O)O

Isomeric SMILES

C1C(CC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)C(=O)C4=NC=C(C5=CC=CC=C54)CC(=O)O

InChI

InChI=1S/C28H22N2O4/c31-25(32)15-21-16-29-26(24-8-4-3-7-23(21)24)27(33)17-9-11-22(12-10-17)30-28(34)20-13-18-5-1-2-6-19(18)14-20/h1-12,16,20H,13-15H2,(H,30,34)(H,31,32)