methyl 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-(2-naphthalen-2-ylethanoylamino)-4-phenoxy-benzoate

Systemtic Name: methyl 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-(2-naphthalen-2-ylethanoylamino)-4-phenoxy-benzoate Openeye Name: methyl 3-[(E)-dimethylaminomethyleneamino]sulfonyl-5-[[2-(2-naphthyl)acetyl]amino]-4-phenoxy-benzoate CAS Name: 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-[[2-(2-naphthalenyl)-1-oxoethyl]amino]-4-phenoxybenzoic acid methyl ester IUPAC Name: methyl 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-[(2-naphthalen-2-ylacetyl)amino]-4-phenoxybenzoate Traditional Name: 3-[(E)-dimethylaminomethyleneamino]sulfonyl-5-[[2-(2-naphthyl)acetyl]amino]-4-phenoxy-benzoic acid methyl ester Formula: C29H27N3O6S MolecularWeight: 545.60618

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NS(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)NC(=O)CC3=CC4=CC=CC=C4C=C3)C(=O)OC

Isomeric SMILES

CN(C)/C=N/S(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)NC(=O)CC3=CC4=CC=CC=C4C=C3)C(=O)OC

InChI

InChI=1S/C29H27N3O6S/c1-32(2)19-30-39(35,36)26-18-23(29(34)37-3)17-25(28(26)38-24-11-5-4-6-12-24)31-27(33)16-20-13-14-21-9-7-8-10-22(21)15-20/h4-15,17-19H,16H2,1-3H3,(H,31,33)/b30-19+