3-[3-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-[3-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-[3-(indan-5-yloxymethyl)-4-methoxy-phenyl]prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-[3-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-methoxyphenyl]-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-[3-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-methoxyphenyl]prop-2-enenitrile Traditional Name: 2-besyl-3-[3-(indan-5-yloxymethyl)-4-methoxy-phenyl]acrylonitrile Formula: C26H23NO4S MolecularWeight: 445.53012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)COC3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)COC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C26H23NO4S/c1-30-26-13-10-19(15-25(17-27)32(28,29)24-8-3-2-4-9-24)14-22(26)18-31-23-12-11-20-6-5-7-21(20)16-23/h2-4,8-16H,5-7,18H2,1H3