2-[2-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]-4-oxidanylidene-azetidin-1-yl]pent-4-enoic acid

Systemtic Name: 2-[2-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]-4-oxidanylidene-azetidin-1-yl]pent-4-enoic acid Openeye Name: 2-[2-[allyl(p-tolylsulfonyl)amino]-4-oxo-azetidin-1-yl]pent-4-enoic acid CAS Name: 2-[2-[(4-methylphenyl)sulfonyl-prop-2-enylamino]-4-oxo-1-azetidinyl]-4-pentenoic acid IUPAC Name: 2-[2-[(4-methylphenyl)sulfonyl-prop-2-enylamino]-4-oxoazetidin-1-yl]pent-4-enoic acid Traditional Name: 2-[2-[allyl(tosyl)amino]-4-keto-azetidin-1-yl]pent-4-enoic acid Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C2CC(=O)N2C(CC=C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C2CC(=O)N2C(CC=C)C(=O)O

InChI

InChI=1S/C18H22N2O5S/c1-4-6-15(18(22)23)20-16(12-17(20)21)19(11-5-2)26(24,25)14-9-7-13(3)8-10-14/h4-5,7-10,15-16H,1-2,6,11-12H2,3H3,(H,22,23)