methyl (2R,4S)-4-azanyl-1-(4-pentylphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-4-azanyl-1-(4-pentylphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-4-amino-1-(4-pentylphenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-amino-1-(4-pentylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-amino-1-(4-pentylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-amino-1-(4-amylphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OC)N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2C[C@H](C[C@@H]2C(=O)OC)N

InChI

InChI=1S/C17H26N2O4S/c1-3-4-5-6-13-7-9-15(10-8-13)24(21,22)19-12-14(18)11-16(19)17(20)23-2/h7-10,14,16H,3-6,11-12,18H2,1-2H3/t14-,16+/m0/s1