4-[7-propan-2-yl-8-propan-2-yloxy-1-(pyridin-3-ylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid

Systemtic Name: 4-[7-propan-2-yl-8-propan-2-yloxy-1-(pyridin-3-ylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid Openeye Name: 4-[8-isopropoxy-7-isopropyl-1-(3-pyridylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid CAS Name: 4-[7-propan-2-yl-8-propan-2-yloxy-1-(3-pyridinylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid IUPAC Name: 4-[7-propan-2-yl-8-propan-2-yloxy-1-(pyridin-3-ylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid Traditional Name: 4-[8-isopropoxy-7-isopropyl-1-(3-pyridylmethyl)-4,5-dihydrobenz[g]indol-3-yl]benzoic acid Formula: C31H32N2O3 MolecularWeight: 480.59738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C2C(=C1)CCC3=C2N(C=C3C4=CC=C(C=C4)C(=O)O)CC5=CN=CC=C5)OC(C)C

Isomeric SMILES

CC(C)C1=C(C=C2C(=C1)CCC3=C2N(C=C3C4=CC=C(C=C4)C(=O)O)CC5=CN=CC=C5)OC(C)C

InChI

InChI=1S/C31H32N2O3/c1-19(2)26-14-24-11-12-25-28(22-7-9-23(10-8-22)31(34)35)18-33(17-21-6-5-13-32-16-21)30(25)27(24)15-29(26)36-20(3)4/h5-10,13-16,18-20H,11-12,17H2,1-4H3,(H,34,35)