(2R)-2-(3-cyclopentyloxy-4-methoxy-phenyl)-5-phenylmethoxy-2-(pyridin-4-ylmethyl)indene-1,3-dione

Systemtic Name: (2R)-2-(3-cyclopentyloxy-4-methoxy-phenyl)-5-phenylmethoxy-2-(pyridin-4-ylmethyl)indene-1,3-dione Openeye Name: (2R)-5-benzyloxy-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridylmethyl)indane-1,3-dione CAS Name: (2R)-2-(3-cyclopentyloxy-4-methoxyphenyl)-5-phenylmethoxy-2-(pyridin-4-ylmethyl)indene-1,3-dione IUPAC Name: (2R)-2-(3-cyclopentyloxy-4-methoxyphenyl)-5-phenylmethoxy-2-(pyridin-4-ylmethyl)indene-1,3-dione Traditional Name: (2R)-5-benzoxy-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridylmethyl)indane-1,3-quinone Formula: C34H31NO5 MolecularWeight: 533.61364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(C(=O)C3=C(C2=O)C=C(C=C3)OCC4=CC=CC=C4)CC5=CC=NC=C5)OC6CCCC6

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@]2(C(=O)C3=C(C2=O)C=C(C=C3)OCC4=CC=CC=C4)CC5=CC=NC=C5)OC6CCCC6

InChI

InChI=1S/C34H31NO5/c1-38-30-14-11-25(19-31(30)40-26-9-5-6-10-26)34(21-23-15-17-35-18-16-23)32(36)28-13-12-27(20-29(28)33(34)37)39-22-24-7-3-2-4-8-24/h2-4,7-8,11-20,26H,5-6,9-10,21-22H2,1H3/t34-/m1/s1