methyl 1-[(4-bromanyl-2-methyl-phenyl)methylcarbamoyloxy]-7-methyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate

Systemtic Name: methyl 1-[(4-bromanyl-2-methyl-phenyl)methylcarbamoyloxy]-7-methyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate Openeye Name: methyl 1-[(4-bromo-2-methyl-phenyl)methylcarbamoyloxy]-7-methyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate CAS Name: 1-[[(4-bromo-2-methylphenyl)methylamino]-oxomethoxy]-7-methyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid methyl ester IUPAC Name: methyl 1-[(4-bromo-2-methylphenyl)methylcarbamoyloxy]-7-methyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate Traditional Name: 1-[(4-bromo-2-methyl-benzyl)carbamoyloxy]-7-methyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid methyl ester Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C1C(OC=C2C(=O)OC)OC(=O)NCC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CC1=CCC2C1C(OC=C2C(=O)OC)OC(=O)NCC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C20H22BrNO5/c1-11-4-7-15-16(18(23)25-3)10-26-19(17(11)15)27-20(24)22-9-13-5-6-14(21)8-12(13)2/h4-6,8,10,15,17,19H,7,9H2,1-3H3,(H,22,24)