4-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-18-phenylmethoxyoctadec-1-enyl]indole

Systemtic Name: 4-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-18-phenylmethoxyoctadec-1-enyl]indole Openeye Name: 3-[(E)-18-benzyloxyoctadec-1-enyl]-4-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]indole CAS Name: 4-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-18-phenylmethoxyoctadec-1-enyl]indole IUPAC Name: 4-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-18-phenylmethoxyoctadec-1-enyl]indole Traditional Name: 3-[(E)-18-benzoxyoctadec-1-enyl]-4-methoxy-1-p-anisylsulfonyl-indole Formula: C42H57NO5S MolecularWeight: 687.97068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CS(=O)(=O)N2C=C(C3=C2C=CC=C3OC)C=CCCCCCCCCCCCCCCCCOCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CS(=O)(=O)N2C=C(C3=C2C=CC=C3OC)/C=C/CCCCCCCCCCCCCCCCOCC4=CC=CC=C4

InChI

InChI=1S/C42H57NO5S/c1-46-39-30-28-37(29-31-39)35-49(44,45)43-33-38(42-40(43)26-22-27-41(42)47-2)25-20-15-13-11-9-7-5-3-4-6-8-10-12-14-16-21-32-48-34-36-23-18-17-19-24-36/h17-20,22-31,33H,3-16,21,32,34-35H2,1-2H3/b25-20+