2-(5-bromanyl-8-chloranyl-1,6-dimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid

Systemtic Name: 2-(5-bromanyl-8-chloranyl-1,6-dimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(5-bromo-8-chloro-1,6-dimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(5-bromo-8-chloro-1,6-dimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(5-bromo-8-chloro-1,6-dimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(5-bromo-8-chloro-1,6-dimethyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C15H15BrClNO3 MolecularWeight: 372.6415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1Br)C3=C(N2)C(OCC3)(C)CC(=O)O)Cl

Isomeric SMILES

CC1=CC(=C2C(=C1Br)C3=C(N2)C(OCC3)(C)CC(=O)O)Cl

InChI

InChI=1S/C15H15BrClNO3/c1-7-5-9(17)13-11(12(7)16)8-3-4-21-15(2,6-10(19)20)14(8)18-13/h5,18H,3-4,6H2,1-2H3,(H,19,20)