1-(4-chloranylbutyl)-5-methoxy-4-phenylmethoxy-indole-3-carbaldehyde

Systemtic Name: 1-(4-chloranylbutyl)-5-methoxy-4-phenylmethoxy-indole-3-carbaldehyde Openeye Name: 4-benzyloxy-1-(4-chlorobutyl)-5-methoxy-indole-3-carbaldehyde CAS Name: 1-(4-chlorobutyl)-5-methoxy-4-phenylmethoxy-3-indolecarboxaldehyde IUPAC Name: 1-(4-chlorobutyl)-5-methoxy-4-phenylmethoxyindole-3-carbaldehyde Traditional Name: 4-benzoxy-1-(4-chlorobutyl)-5-methoxy-indole-3-carbaldehyde Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N(C=C2C=O)CCCCCl)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C2=C(C=C1)N(C=C2C=O)CCCCCl)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22ClNO3/c1-25-19-10-9-18-20(17(14-24)13-23(18)12-6-5-11-22)21(19)26-15-16-7-3-2-4-8-16/h2-4,7-10,13-14H,5-6,11-12,15H2,1H3