[2-[[(2S)-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[(2S)-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[[(1S)-1-benzyl-2-[(4-methyl-2-oxo-chromen-7-yl)amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]ammonium CAS Name: [2-[[(2S)-1-[(4-methyl-2-oxo-1-benzopyran-7-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]ammonium IUPAC Name: [2-[[(2S)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]azanium Traditional Name: [2-[[(1S)-1-benzyl-2-keto-2-[(2-keto-4-methyl-chromen-7-yl)amino]ethyl]amino]-2-keto-ethyl]ammonium Formula: C21H22N3O4+ MolecularWeight: 380.41708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C[NH3+]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)C[NH3+]

InChI

InChI=1S/C21H21N3O4/c1-13-9-20(26)28-18-11-15(7-8-16(13)18)23-21(27)17(24-19(25)12-22)10-14-5-3-2-4-6-14/h2-9,11,17H,10,12,22H2,1H3,(H,23,27)(H,24,25)/p+1/t17-/m0/s1