(3S,11aS)-1-methoxy-3-prop-2-enyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one

Systemtic Name: (3S,11aS)-1-methoxy-3-prop-2-enyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one Openeye Name: (3S,11aS)-3-allyl-1-methoxy-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one CAS Name: (3S,11aS)-1-methoxy-3-prop-2-enyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one IUPAC Name: (3S,11aS)-1-methoxy-3-prop-2-enyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one Traditional Name: (3S,11aS)-3-allyl-1-methoxy-3,6,11,11a-tetrahydropyrazin[1,2-b]isoquinolin-4-one Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(C(=O)N2C1CC3=CC=CC=C3C2)CC=C

Isomeric SMILES

COC1=N[C@H](C(=O)N2[C@H]1CC3=CC=CC=C3C2)CC=C

InChI

InChI=1S/C16H18N2O2/c1-3-6-13-16(19)18-10-12-8-5-4-7-11(12)9-14(18)15(17-13)20-2/h3-5,7-8,13-14H,1,6,9-10H2,2H3/t13-,14-/m0/s1