methyl (2S)-4-methyl-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enyl-amino]pentanoate

Systemtic Name: methyl (2S)-4-methyl-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enyl-amino]pentanoate Openeye Name: methyl (2S)-2-[allyl-[(E)-styryl]sulfonyl-amino]-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enylamino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-4-methyl-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enylamino]pentanoate Traditional Name: (2S)-2-[allyl-[(E)-styryl]sulfonyl-amino]-4-methyl-valeric acid methyl ester Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)N(CC=C)S(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)N(CC=C)S(=O)(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C18H25NO4S/c1-5-12-19(17(14-15(2)3)18(20)23-4)24(21,22)13-11-16-9-7-6-8-10-16/h5-11,13,15,17H,1,12,14H2,2-4H3/b13-11+/t17-/m0/s1