methyl 3-[1-(4-butoxyphenyl)sulfonyl-5-methoxy-indol-3-yl]propanoate

Systemtic Name: methyl 3-[1-(4-butoxyphenyl)sulfonyl-5-methoxy-indol-3-yl]propanoate Openeye Name: methyl 3-[1-(4-butoxyphenyl)sulfonyl-5-methoxy-indol-3-yl]propanoate CAS Name: 3-[1-(4-butoxyphenyl)sulfonyl-5-methoxy-3-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(4-butoxyphenyl)sulfonyl-5-methoxyindol-3-yl]propanoate Traditional Name: 3-[1-(4-butoxyphenyl)sulfonyl-5-methoxy-indol-3-yl]propionic acid methyl ester Formula: C23H27NO6S MolecularWeight: 445.52858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)OC)CCC(=O)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)OC)CCC(=O)OC

InChI

InChI=1S/C23H27NO6S/c1-4-5-14-30-18-7-10-20(11-8-18)31(26,27)24-16-17(6-13-23(25)29-3)21-15-19(28-2)9-12-22(21)24/h7-12,15-16H,4-6,13-14H2,1-3H3