3-[4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]butanoylamino]propyl-diethyl-azanium

Systemtic Name: 3-[4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]butanoylamino]propyl-diethyl-azanium Openeye Name: 3-[4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butanoylamino]propyl-diethyl-ammonium CAS Name: 3-[[4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-1-oxobutyl]amino]propyl-diethylammonium IUPAC Name: 3-[4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butanoylamino]propyl-diethylazanium Traditional Name: 3-[4-(1,3-diketobenzo[de]isoquinolin-2-yl)butanoylamino]propyl-diethyl-ammonium Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)CCCN1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)CCCN1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O

InChI

InChI=1S/C23H29N3O3/c1-3-25(4-2)15-8-14-24-20(27)13-7-16-26-22(28)18-11-5-9-17-10-6-12-19(21(17)18)23(26)29/h5-6,9-12H,3-4,7-8,13-16H2,1-2H3,(H,24,27)/p+1