diethyl 2-[[2-(naphthalen-1-ylmethyl)-1-(phenylsulfonyl)indol-3-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[2-(naphthalen-1-ylmethyl)-1-(phenylsulfonyl)indol-3-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[1-(benzenesulfonyl)-2-(1-naphthylmethyl)indol-3-yl]methylene]propanedioate CAS Name: 2-[[1-(benzenesulfonyl)-2-(1-naphthalenylmethyl)-3-indolyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[1-(benzenesulfonyl)-2-(naphthalen-1-ylmethyl)indol-3-yl]methylidene]propanedioate Traditional Name: 2-[[1-besyl-2-(1-naphthylmethyl)indol-3-yl]methylene]malonic acid diethyl ester Formula: C33H29NO6S MolecularWeight: 567.65146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54)C(=O)OCC

InChI

InChI=1S/C33H29NO6S/c1-3-39-32(35)29(33(36)40-4-2)22-28-27-19-10-11-20-30(27)34(41(37,38)25-16-6-5-7-17-25)31(28)21-24-15-12-14-23-13-8-9-18-26(23)24/h5-20,22H,3-4,21H2,1-2H3