3-[7-methoxy-1-(phenylmethyl)-4,5-dihydrobenzo[g]indazol-3-yl]propanoic acid

Systemtic Name: 3-[7-methoxy-1-(phenylmethyl)-4,5-dihydrobenzo[g]indazol-3-yl]propanoic acid Openeye Name: 3-(1-benzyl-7-methoxy-4,5-dihydrobenzo[g]indazol-3-yl)propanoic acid CAS Name: 3-[7-methoxy-1-(phenylmethyl)-4,5-dihydrobenzo[g]indazol-3-yl]propanoic acid IUPAC Name: 3-(1-benzyl-7-methoxy-4,5-dihydrobenzo[g]indazol-3-yl)propanoic acid Traditional Name: 3-(1-benzyl-7-methoxy-4,5-dihydrobenz[g]indazol-3-yl)propionic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C(=NN3CC4=CC=CC=C4)CCC(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C(=NN3CC4=CC=CC=C4)CCC(=O)O

InChI

InChI=1S/C22H22N2O3/c1-27-17-8-10-18-16(13-17)7-9-19-20(11-12-21(25)26)23-24(22(18)19)14-15-5-3-2-4-6-15/h2-6,8,10,13H,7,9,11-12,14H2,1H3,(H,25,26)