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

Systemtic Name: 4-[8-methoxy-7-propan-2-yl-1-(pyridin-3-ylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid Openeye Name: 4-[7-isopropyl-8-methoxy-1-(3-pyridylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid CAS Name: 4-[8-methoxy-7-propan-2-yl-1-(3-pyridinylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid IUPAC Name: 4-[8-methoxy-7-propan-2-yl-1-(pyridin-3-ylmethyl)-4,5-dihydrobenzo[g]indol-3-yl]benzoic acid Traditional Name: 4-[7-isopropyl-8-methoxy-1-(3-pyridylmethyl)-4,5-dihydrobenz[g]indol-3-yl]benzoic acid Formula: C29H28N2O3 MolecularWeight: 452.54422

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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

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

InChI

InChI=1S/C29H28N2O3/c1-18(2)24-13-22-10-11-23-26(20-6-8-21(9-7-20)29(32)33)17-31(16-19-5-4-12-30-15-19)28(23)25(22)14-27(24)34-3/h4-9,12-15,17-18H,10-11,16H2,1-3H3,(H,32,33)