6-chloranyl-9-cyclopentyl-3,4-dimethyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one

Systemtic Name: 6-chloranyl-9-cyclopentyl-3,4-dimethyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 6-chloro-9-cyclopentyl-3,4-dimethyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 6-chloro-9-cyclopentyl-3,4-dimethyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 6-chloro-9-cyclopentyl-3,4-dimethyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 6-chloro-9-cyclopentyl-3,4-dimethyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C18H21ClNO3+ MolecularWeight: 334.81724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C3C[NH+](COC3=C(C=C12)Cl)C4CCCC4)C

Isomeric SMILES

CC1=C(C(=O)OC2=C3C[NH+](COC3=C(C=C12)Cl)C4CCCC4)C

InChI

InChI=1S/C18H20ClNO3/c1-10-11(2)18(21)23-16-13(10)7-15(19)17-14(16)8-20(9-22-17)12-5-3-4-6-12/h7,12H,3-6,8-9H2,1-2H3/p+1