cyclopentyl-[3-(2,2-dimethylpropanoylamino)-2-oxidanyl-chromen-4-ylidene]azanium

Systemtic Name: cyclopentyl-[3-(2,2-dimethylpropanoylamino)-2-oxidanyl-chromen-4-ylidene]azanium Openeye Name: cyclopentyl-[3-(2,2-dimethylpropanoylamino)-2-hydroxy-chromen-4-ylidene]ammonium CAS Name: cyclopentyl-[3-[(2,2-dimethyl-1-oxopropyl)amino]-2-hydroxy-1-benzopyran-4-ylidene]ammonium IUPAC Name: cyclopentyl-[3-(2,2-dimethylpropanoylamino)-2-hydroxychromen-4-ylidene]azanium Traditional Name: cyclopentyl-[2-hydroxy-3-(pivaloylamino)chromen-4-ylidene]ammonium Formula: C19H25N2O3+ MolecularWeight: 329.4134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(OC2=CC=CC=C2C1=[NH+]C3CCCC3)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(OC2=CC=CC=C2C1=[NH+]C3CCCC3)O

InChI

InChI=1S/C19H24N2O3/c1-19(2,3)18(23)21-16-15(20-12-8-4-5-9-12)13-10-6-7-11-14(13)24-17(16)22/h6-7,10-12,22H,4-5,8-9H2,1-3H3,(H,21,23)/p+1