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

Systemtic Name: 2-[(4R)-1-ethyl-8-methyl-4-prop-2-enyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[(4R)-4-allyl-1-ethyl-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[(4R)-1-ethyl-8-methyl-4-prop-2-enyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[(4R)-1-ethyl-8-methyl-4-prop-2-enyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[(4R)-4-allyl-1-ethyl-8-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)CC=C)C3=C(N2)C(=CC=C3)C)CC(=O)O

Isomeric SMILES

CCC1(C2=C([C@H](CO1)CC=C)C3=C(N2)C(=CC=C3)C)CC(=O)O

InChI

InChI=1S/C19H23NO3/c1-4-7-13-11-23-19(5-2,10-15(21)22)18-16(13)14-9-6-8-12(3)17(14)20-18/h4,6,8-9,13,20H,1,5,7,10-11H2,2-3H3,(H,21,22)/t13-,19?/m0/s1