(4-methylphenyl)sulfonyl 4-(2-methoxyethyl)pyrrolidine-2-carboxylate; pyrrolidine-2-carbonitrile

Systemtic Name: (4-methylphenyl)sulfonyl 4-(2-methoxyethyl)pyrrolidine-2-carboxylate; pyrrolidine-2-carbonitrile Openeye Name: p-tolylsulfonyl 4-(2-methoxyethyl)pyrrolidine-2-carboxylate; pyrrolidine-2-carbonitrile CAS Name: 4-(2-methoxyethyl)-2-pyrrolidinecarboxylic acid (4-methylphenyl)sulfonyl ester; 2-pyrrolidinecarbonitrile IUPAC Name: (4-methylphenyl)sulfonyl 4-(2-methoxyethyl)pyrrolidine-2-carboxylate; pyrrolidine-2-carbonitrile Traditional Name: 4-(2-methoxyethyl)pyrrolidine-2-carboxylic acid tosyl ester; pyrrolidine-2-carbonitrile Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(=O)C2CC(CN2)CCOC.C1CC(NC1)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(=O)C2CC(CN2)CCOC.C1CC(NC1)C#N

InChI

InChI=1S/C15H21NO5S.C5H8N2/c1-11-3-5-13(6-4-11)22(18,19)21-15(17)14-9-12(10-16-14)7-8-20-2;6-4-5-2-1-3-7-5/h3-6,12,14,16H,7-10H2,1-2H3;5,7H,1-3H2