2-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydrobenzo[f]isoquinoline; prop-2-enyl carbamate

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydrobenzo[f]isoquinoline; prop-2-enyl carbamate Openeye Name: allyl carbamate; 2-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydrobenzo[f]isoquinoline CAS Name: carbamic acid prop-2-enyl ester; 2-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydrobenzo[f]isoquinoline IUPAC Name: 2-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydrobenzo[f]isoquinoline; prop-2-enyl carbamate Traditional Name: carbamic acid allyl ester; 2-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydrobenz[f]isoquinoline Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2CC3=C(CN2)C=CC4=CC=CC=C34.C=CCOC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2CC3=C(CN2)C=CC4=CC=CC=C34.C=CCOC(=O)N

InChI

InChI=1S/C20H19NO3S.C4H7NO2/c1-24-16-8-10-17(11-9-16)25(22,23)20-12-19-15(13-21-20)7-6-14-4-2-3-5-18(14)19;1-2-3-7-4(5)6/h2-11,20-21H,12-13H2,1H3;2H,1,3H2,(H2,5,6)