2-(1-ethyl-4-methyl-8-prop-2-enyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid

Systemtic Name: 2-(1-ethyl-4-methyl-8-prop-2-enyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(8-allyl-1-ethyl-4-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(1-ethyl-4-methyl-8-prop-2-enyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(1-ethyl-4-methyl-8-prop-2-enyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(8-allyl-1-ethyl-4-methyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(C(CO1)C)C3=C(N2)C(=CC=C3)CC=C)CC(=O)O

Isomeric SMILES

CCC1(C2=C(C(CO1)C)C3=C(N2)C(=CC=C3)CC=C)CC(=O)O

InChI

InChI=1S/C19H23NO3/c1-4-7-13-8-6-9-14-16-12(3)11-23-19(5-2,10-15(21)22)18(16)20-17(13)14/h4,6,8-9,12,20H,1,5,7,10-11H2,2-3H3,(H,21,22)