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

Systemtic Name: diethyl-[(4S)-4-[2-[3-(2-methoxyphenyl)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]pentyl]azanium Openeye Name: diethyl-[(4S)-4-[[2-[3-(2-methoxyphenyl)-4-oxo-chromen-7-yl]oxyacetyl]amino]pentyl]ammonium CAS Name: diethyl-[(4S)-4-[[2-[[3-(2-methoxyphenyl)-4-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]pentyl]ammonium IUPAC Name: diethyl-[(4S)-4-[[2-[3-(2-methoxyphenyl)-4-oxochromen-7-yl]oxyacetyl]amino]pentyl]azanium Traditional Name: diethyl-[(4S)-4-[[2-[4-keto-3-(2-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=CC=C3OC

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3OC

InChI

InChI=1S/C27H34N2O5/c1-5-29(6-2)15-9-10-19(3)28-26(30)18-33-20-13-14-22-25(16-20)34-17-23(27(22)31)21-11-7-8-12-24(21)32-4/h7-8,11-14,16-17,19H,5-6,9-10,15,18H2,1-4H3,(H,28,30)/p+1/t19-/m0/s1