ethyl-[3-(3-methylbutylcarbamoylamino)-2-oxidanyl-chromen-4-ylidene]azanium

Systemtic Name: ethyl-[3-(3-methylbutylcarbamoylamino)-2-oxidanyl-chromen-4-ylidene]azanium Openeye Name: ethyl-[2-hydroxy-3-(isopentylcarbamoylamino)chromen-4-ylidene]ammonium CAS Name: ethyl-[2-hydroxy-3-[[(3-methylbutylamino)-oxomethyl]amino]-1-benzopyran-4-ylidene]ammonium IUPAC Name: ethyl-[2-hydroxy-3-(3-methylbutylcarbamoylamino)chromen-4-ylidene]azanium Traditional Name: ethyl-[2-hydroxy-3-(isoamylcarbamoylamino)chromen-4-ylidene]ammonium Formula: C17H24N3O3+ MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]=C1C2=CC=CC=C2OC(=C1NC(=O)NCCC(C)C)O

Isomeric SMILES

CC[NH+]=C1C2=CC=CC=C2OC(=C1NC(=O)NCCC(C)C)O

InChI

InChI=1S/C17H23N3O3/c1-4-18-14-12-7-5-6-8-13(12)23-16(21)15(14)20-17(22)19-10-9-11(2)3/h5-8,11,21H,4,9-10H2,1-3H3,(H2,19,20,22)/p+1