tert-butyl 8-methoxy-1-(oxan-2-yloxymethyl)-5-phenylmethoxy-1,2-dihydrobenzo[e]indole-3-carboxylate

Systemtic Name: tert-butyl 8-methoxy-1-(oxan-2-yloxymethyl)-5-phenylmethoxy-1,2-dihydrobenzo[e]indole-3-carboxylate Openeye Name: tert-butyl 5-benzyloxy-8-methoxy-1-(tetrahydropyran-2-yloxymethyl)-1,2-dihydrobenzo[e]indole-3-carboxylate CAS Name: 8-methoxy-1-(2-oxanyloxymethyl)-5-phenylmethoxy-1,2-dihydrobenzo[e]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-methoxy-1-(oxan-2-yloxymethyl)-5-phenylmethoxy-1,2-dihydrobenzo[e]indole-3-carboxylate Traditional Name: 5-benzoxy-8-methoxy-1-(tetrahydropyran-2-yloxymethyl)-1,2-dihydrobenz[e]indole-3-carboxylic acid tert-butyl ester Formula: C31H37NO6 MolecularWeight: 519.62858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C2=C3C=C(C=CC3=C(C=C21)OCC4=CC=CC=C4)OC)COC5CCCCO5

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C2=C3C=C(C=CC3=C(C=C21)OCC4=CC=CC=C4)OC)COC5CCCCO5

InChI

InChI=1S/C31H37NO6/c1-31(2,3)38-30(33)32-18-22(20-37-28-12-8-9-15-35-28)29-25-16-23(34-4)13-14-24(25)27(17-26(29)32)36-19-21-10-6-5-7-11-21/h5-7,10-11,13-14,16-17,22,28H,8-9,12,15,18-20H2,1-4H3