(phenylmethyl) N-[3-[(R)-cyclopropyl-(2-oxidanyl-4-oxidanylidene-5,6,7,8,9,10-hexahydrocycloocta[b]pyran-3-yl)methyl]phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[(R)-cyclopropyl-(2-oxidanyl-4-oxidanylidene-5,6,7,8,9,10-hexahydrocycloocta[b]pyran-3-yl)methyl]phenyl]carbamate Openeye Name: benzyl N-[3-[(R)-cyclopropyl-(2-hydroxy-4-oxo-5,6,7,8,9,10-hexahydrocycloocta[b]pyran-3-yl)methyl]phenyl]carbamate CAS Name: N-[3-[(R)-cyclopropyl-(2-hydroxy-4-oxo-5,6,7,8,9,10-hexahydrocycloocta[b]pyran-3-yl)methyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[(R)-cyclopropyl-(2-hydroxy-4-oxo-5,6,7,8,9,10-hexahydrocycloocta[b]pyran-3-yl)methyl]phenyl]carbamate Traditional Name: N-[3-[(R)-cyclopropyl-(2-hydroxy-4-keto-5,6,7,8,9,10-hexahydrocycloocta[b]pyran-3-yl)methyl]phenyl]carbamic acid benzyl ester Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C(=O)C(=C(O2)O)C(C3CC3)C4=CC(=CC=C4)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CCCC2=C(CC1)C(=O)C(=C(O2)O)[C@H](C3CC3)C4=CC(=CC=C4)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H31NO5/c31-27-23-13-6-1-2-7-14-24(23)35-28(32)26(27)25(20-15-16-20)21-11-8-12-22(17-21)30-29(33)34-18-19-9-4-3-5-10-19/h3-5,8-12,17,20,25,32H,1-2,6-7,13-16,18H2,(H,30,33)/t25-/m1/s1