methyl N-[(2R)-1-[1-(phenylsulfonyl)indol-3-yl]pent-4-en-2-yl]carbamate

Systemtic Name: methyl N-[(2R)-1-[1-(phenylsulfonyl)indol-3-yl]pent-4-en-2-yl]carbamate Openeye Name: methyl N-[(1R)-1-[[1-(benzenesulfonyl)indol-3-yl]methyl]but-3-enyl]carbamate CAS Name: N-[(2R)-1-[1-(benzenesulfonyl)-3-indolyl]pent-4-en-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[(2R)-1-[1-(benzenesulfonyl)indol-3-yl]pent-4-en-2-yl]carbamate Traditional Name: N-[(1R)-1-[(1-besylindol-3-yl)methyl]but-3-enyl]carbamic acid methyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CC=C)CC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)N[C@H](CC=C)CC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S/c1-3-9-17(22-21(24)27-2)14-16-15-23(20-13-8-7-12-19(16)20)28(25,26)18-10-5-4-6-11-18/h3-8,10-13,15,17H,1,9,14H2,2H3,(H,22,24)/t17-/m1/s1