methyl 3-(1H-indol-3-yl)-2-[2-naphthalen-2-ylethynyl(phenylsulfonyl)amino]propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[2-naphthalen-2-ylethynyl(phenylsulfonyl)amino]propanoate Openeye Name: methyl 2-[benzenesulfonyl-[2-(2-naphthyl)ethynyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[benzenesulfonyl-[2-(2-naphthalenyl)ethynyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[benzenesulfonyl(2-naphthalen-2-ylethynyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[besyl-[2-(2-naphthyl)ethynyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C30H24N2O4S MolecularWeight: 508.58756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)N(C#CC3=CC4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)N(C#CC3=CC4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H24N2O4S/c1-36-30(33)29(20-25-21-31-28-14-8-7-13-27(25)28)32(37(34,35)26-11-3-2-4-12-26)18-17-22-15-16-23-9-5-6-10-24(23)19-22/h2-16,19,21,29,31H,20H2,1H3