diethyl-[3-[[4-(4-methylphenyl)-1-oxidanylidene-isochromen-3-yl]carbonylamino]propyl]azanium

Systemtic Name: diethyl-[3-[[4-(4-methylphenyl)-1-oxidanylidene-isochromen-3-yl]carbonylamino]propyl]azanium Openeye Name: diethyl-[3-[[1-oxo-4-(p-tolyl)isochromene-3-carbonyl]amino]propyl]ammonium CAS Name: diethyl-[3-[[[4-(4-methylphenyl)-1-oxo-2-benzopyran-3-yl]-oxomethyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[[4-(4-methylphenyl)-1-oxoisochromene-3-carbonyl]amino]propyl]azanium Traditional Name: diethyl-[3-[[1-keto-4-(p-tolyl)isochromene-3-carbonyl]amino]propyl]ammonium Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=C(C2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=C(C2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H28N2O3/c1-4-26(5-2)16-8-15-25-23(27)22-21(18-13-11-17(3)12-14-18)19-9-6-7-10-20(19)24(28)29-22/h6-7,9-14H,4-5,8,15-16H2,1-3H3,(H,25,27)/p+1