2-[5-(4-phenylphenyl)-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid

Systemtic Name: 2-[5-(4-phenylphenyl)-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[5-(4-phenylphenyl)-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[5-(4-phenylphenyl)-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[5-(4-phenylphenyl)-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[5-(4-phenylphenyl)-1-propyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C(CCO1)C3=C(C=CC=C3N2)C4=CC=C(C=C4)C5=CC=CC=C5)CC(=O)O

Isomeric SMILES

CCCC1(C2=C(CCO1)C3=C(C=CC=C3N2)C4=CC=C(C=C4)C5=CC=CC=C5)CC(=O)O

InChI

InChI=1S/C28H27NO3/c1-2-16-28(18-25(30)31)27-23(15-17-32-28)26-22(9-6-10-24(26)29-27)21-13-11-20(12-14-21)19-7-4-3-5-8-19/h3-14,29H,2,15-18H2,1H3,(H,30,31)