methyl (2R)-2-[(4-butoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[(4-butoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[(4-butoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[(4-butoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(4-butoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[(4-butoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C22H26N2O5S/c1-3-4-13-29-17-9-11-18(12-10-17)30(26,27)24-21(22(25)28-2)14-16-15-23-20-8-6-5-7-19(16)20/h5-12,15,21,23-24H,3-4,13-14H2,1-2H3/t21-/m1/s1