2-[4-[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-[(2R)-2-(4-ethoxyphenyl)pyrrolidine-1-carbonyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[[(2R)-2-(4-ethoxyphenyl)-1-pyrrolidinyl]-oxomethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[(2R)-2-(4-ethoxyphenyl)pyrrolidine-1-carbonyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[(2R)-2-p-phenetylpyrrolidine-1-carbonyl]piperidino]sulfonylbenzonitrile Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2CCCN2C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H29N3O4S/c1-2-32-22-11-9-19(10-12-22)23-7-5-15-28(23)25(29)20-13-16-27(17-14-20)33(30,31)24-8-4-3-6-21(24)18-26/h3-4,6,8-12,20,23H,2,5,7,13-17H2,1H3/t23-/m1/s1