6-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-12-phenylmethoxydodec-1-enyl]indole

Systemtic Name: 6-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-12-phenylmethoxydodec-1-enyl]indole Openeye Name: 3-[(E)-12-benzyloxydodec-1-enyl]-6-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]indole CAS Name: 6-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-12-phenylmethoxydodec-1-enyl]indole IUPAC Name: 6-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-12-phenylmethoxydodec-1-enyl]indole Traditional Name: 3-[(E)-12-benzoxydodec-1-enyl]-6-methoxy-1-p-anisylsulfonyl-indole Formula: C36H45NO5S MolecularWeight: 603.8112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CS(=O)(=O)N2C=C(C3=C2C=C(C=C3)OC)C=CCCCCCCCCCCOCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CS(=O)(=O)N2C=C(C3=C2C=C(C=C3)OC)/C=C/CCCCCCCCCCOCC4=CC=CC=C4

InChI

InChI=1S/C36H45NO5S/c1-40-33-21-19-31(20-22-33)29-43(38,39)37-27-32(35-24-23-34(41-2)26-36(35)37)18-14-9-7-5-3-4-6-8-10-15-25-42-28-30-16-12-11-13-17-30/h11-14,16-24,26-27H,3-10,15,25,28-29H2,1-2H3/b18-14+