ethyl 4-[[3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-methyl-2-[[(E)-styryl]sulfonylamino]butanoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[3-methyl-1-oxo-2-[[(E)-2-phenylethenyl]sulfonylamino]butyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-methyl-2-[[(E)-styryl]sulfonylamino]butanoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C(C(C)C)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C(C(C)C)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H31N3O5S/c1-4-29-21(26)24-13-10-18(11-14-24)22-20(25)19(16(2)3)23-30(27,28)15-12-17-8-6-5-7-9-17/h5-9,12,15-16,18-19,23H,4,10-11,13-14H2,1-3H3,(H,22,25)/b15-12+