diethyl-[(4S)-4-[2-[3-(4-methoxyphenyl)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]pentyl]azanium

Systemtic Name: diethyl-[(4S)-4-[2-[3-(4-methoxyphenyl)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]pentyl]azanium Openeye Name: diethyl-[(4S)-4-[[2-[3-(4-methoxyphenyl)-4-oxo-chromen-7-yl]oxyacetyl]amino]pentyl]ammonium CAS Name: diethyl-[(4S)-4-[[2-[[3-(4-methoxyphenyl)-4-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]pentyl]ammonium IUPAC Name: diethyl-[(4S)-4-[[2-[3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxyacetyl]amino]pentyl]azanium Traditional Name: diethyl-[(4S)-4-[[2-[4-keto-3-(4-methoxyphenyl)chromen-7-yl]oxyacetyl]amino]pentyl]ammonium Formula: C27H35N2O5+ MolecularWeight: 467.5772

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C27H34N2O5/c1-5-29(6-2)15-7-8-19(3)28-26(30)18-33-22-13-14-23-25(16-22)34-17-24(27(23)31)20-9-11-21(32-4)12-10-20/h9-14,16-17,19H,5-8,15,18H2,1-4H3,(H,28,30)/p+1/t19-/m0/s1