2-(1-methyl-6-phenylmethoxy-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid

Systemtic Name: 2-(1-methyl-6-phenylmethoxy-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(6-benzyloxy-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(1-methyl-6-phenylmethoxy-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(1-methyl-6-phenylmethoxy-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(6-benzoxy-1-methyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(CCO1)C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1(C2=C(CCO1)C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C21H21NO4/c1-21(12-19(23)24)20-16(9-10-26-21)17-11-15(7-8-18(17)22-20)25-13-14-5-3-2-4-6-14/h2-8,11,22H,9-10,12-13H2,1H3,(H,23,24)