(3aS,7aR)-3-methoxy-2-pent-4-ynyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one

Systemtic Name: (3aS,7aR)-3-methoxy-2-pent-4-ynyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Openeye Name: (3aS,7aR)-3-methoxy-2-pent-4-ynyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one CAS Name: (3aS,7aR)-3-methoxy-2-pent-4-ynyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one IUPAC Name: (3aS,7aR)-3-methoxy-2-pent-4-ynyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Traditional Name: (3aS,7aR)-3-methoxy-2-pent-4-ynyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2CC=CCC2C(=O)N1CCCC#C

Isomeric SMILES

COC1[C@H]2CC=CC[C@H]2C(=O)N1CCCC#C

InChI

InChI=1S/C14H19NO2/c1-3-4-7-10-15-13(16)11-8-5-6-9-12(11)14(15)17-2/h1,5-6,11-12,14H,4,7-10H2,2H3/t11-,12+,14?/m1/s1