[(1R,6R)-6-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]cyclohept-3-en-1-yl] ethanoate

Systemtic Name: [(1R,6R)-6-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]cyclohept-3-en-1-yl] ethanoate Openeye Name: [(1R,6R)-6-[allyl(p-tolylsulfonyl)amino]cyclohept-3-en-1-yl] acetate CAS Name: acetic acid [(1R,6R)-6-[(4-methylphenyl)sulfonyl-prop-2-enylamino]-1-cyclohept-3-enyl] ester IUPAC Name: [(1R,6R)-6-[(4-methylphenyl)sulfonyl-prop-2-enylamino]cyclohept-3-en-1-yl] acetate Traditional Name: acetic acid [(1R,6R)-6-[allyl(tosyl)amino]cyclohept-3-en-1-yl] ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C2CC=CCC(C2)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C)[C@@H]2CC=CC[C@H](C2)OC(=O)C

InChI

InChI=1S/C19H25NO4S/c1-4-13-20(25(22,23)19-11-9-15(2)10-12-19)17-7-5-6-8-18(14-17)24-16(3)21/h4-6,9-12,17-18H,1,7-8,13-14H2,2-3H3/t17-,18-/m1/s1