[4-[4-[3-(2-azanylethoxy)phenyl]-3-methyl-phenyl]piperidin-1-yl]sulfonyl 2-methylpropanoate

Systemtic Name: [4-[4-[3-(2-azanylethoxy)phenyl]-3-methyl-phenyl]piperidin-1-yl]sulfonyl 2-methylpropanoate Openeye Name: [4-[4-[3-(2-aminoethoxy)phenyl]-3-methyl-phenyl]-1-piperidyl]sulfonyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid [4-[4-[3-(2-aminoethoxy)phenyl]-3-methylphenyl]-1-piperidinyl]sulfonyl ester IUPAC Name: [4-[4-[3-(2-aminoethoxy)phenyl]-3-methylphenyl]piperidin-1-yl]sulfonyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid [4-[4-[3-(2-aminoethoxy)phenyl]-3-methyl-phenyl]piperidino]sulfonyl ester Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)OC(=O)C(C)C)C3=CC(=CC=C3)OCCN

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)OC(=O)C(C)C)C3=CC(=CC=C3)OCCN

InChI

InChI=1S/C24H32N2O5S/c1-17(2)24(27)31-32(28,29)26-12-9-19(10-13-26)20-7-8-23(18(3)15-20)21-5-4-6-22(16-21)30-14-11-25/h4-8,15-17,19H,9-14,25H2,1-3H3