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

Systemtic Name: 2-[(4R)-1-ethyl-4-prop-2-enyl-8-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[(4R)-4-allyl-1-ethyl-8-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[(4R)-1-ethyl-4-prop-2-enyl-8-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[(4R)-1-ethyl-4-prop-2-enyl-8-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[(4R)-4-allyl-1-ethyl-8-propyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC2=C1NC3=C2C(COC3(CC)CC(=O)O)CC=C

Isomeric SMILES

CCCC1=CC=CC2=C1NC3=C2[C@H](COC3(CC)CC(=O)O)CC=C

InChI

InChI=1S/C21H27NO3/c1-4-8-14-10-7-11-16-18-15(9-5-2)13-25-21(6-3,12-17(23)24)20(18)22-19(14)16/h5,7,10-11,15,22H,2,4,6,8-9,12-13H2,1,3H3,(H,23,24)/t15-,21?/m0/s1