5-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-16-phenylmethoxyhexadec-1-enyl]indole

Systemtic Name: 5-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-16-phenylmethoxyhexadec-1-enyl]indole Openeye Name: 3-[(E)-16-benzyloxyhexadec-1-enyl]-5-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]indole CAS Name: 5-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-16-phenylmethoxyhexadec-1-enyl]indole IUPAC Name: 5-methoxy-1-[(4-methoxyphenyl)methylsulfonyl]-3-[(E)-16-phenylmethoxyhexadec-1-enyl]indole Traditional Name: 3-[(E)-16-benzoxyhexadec-1-enyl]-5-methoxy-1-p-anisylsulfonyl-indole Formula: C40H53NO5S MolecularWeight: 659.91752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CS(=O)(=O)N2C=C(C3=C2C=CC(=C3)OC)C=CCCCCCCCCCCCCCCOCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CS(=O)(=O)N2C=C(C3=C2C=CC(=C3)OC)/C=C/CCCCCCCCCCCCCCOCC4=CC=CC=C4

InChI

InChI=1S/C40H53NO5S/c1-44-37-25-23-35(24-26-37)33-47(42,43)41-31-36(39-30-38(45-2)27-28-40(39)41)22-18-13-11-9-7-5-3-4-6-8-10-12-14-19-29-46-32-34-20-16-15-17-21-34/h15-18,20-28,30-31H,3-14,19,29,32-33H2,1-2H3/b22-18+