[(2S)-5-azaniumyl-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-5-azaniumyl-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(4S)-4-azaniumyl-5-[(4-methyl-2-oxo-chromen-7-yl)amino]-5-oxo-pentyl]ammonium CAS Name: [(2S)-5-ammonio-1-[(4-methyl-2-oxo-1-benzopyran-7-yl)amino]-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-5-azaniumyl-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]azanium Traditional Name: [(4S)-4-ammonio-5-keto-5-[(2-keto-4-methyl-chromen-7-yl)amino]pentyl]ammonium Formula: C15H21N3O3+2 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCC[NH3+])[NH3+]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CCC[NH3+])[NH3+]

InChI

InChI=1S/C15H19N3O3/c1-9-7-14(19)21-13-8-10(4-5-11(9)13)18-15(20)12(17)3-2-6-16/h4-5,7-8,12H,2-3,6,16-17H2,1H3,(H,18,20)/p+2/t12-/m0/s1