[3-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanyl-chromen-4-ylidene]-ethyl-azanium

Systemtic Name: [3-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanyl-chromen-4-ylidene]-ethyl-azanium Openeye Name: ethyl-[2-hydroxy-3-[[(1R)-1-methylpropyl]carbamoylamino]chromen-4-ylidene]ammonium CAS Name: [3-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]-ethylammonium IUPAC Name: [3-[[(2R)-butan-2-yl]carbamoylamino]-2-hydroxychromen-4-ylidene]-ethylazanium Traditional Name: ethyl-[2-hydroxy-3-[[(1R)-1-methylpropyl]carbamoylamino]chromen-4-ylidene]ammonium Formula: C16H22N3O3+ MolecularWeight: 304.36418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C)NC(=O)NC1=C(OC2=CC=CC=C2C1=[NH+]CC)O

InChI

InChI=1S/C16H21N3O3/c1-4-10(3)18-16(21)19-14-13(17-5-2)11-8-6-7-9-12(11)22-15(14)20/h6-10,20H,4-5H2,1-3H3,(H2,18,19,21)/p+1/t10-/m1/s1