diethyl-[3-[[2-(4-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]propyl]azanium

Systemtic Name: diethyl-[3-[[2-(4-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]propyl]azanium Openeye Name: diethyl-[3-[[2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carbonyl]amino]propyl]ammonium CAS Name: diethyl-[3-[[[2-(4-methoxyphenyl)-1-oxo-4-isoquinolinyl]-oxomethyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[[2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carbonyl]amino]propyl]azanium Traditional Name: diethyl-[3-[[1-keto-2-(4-methoxyphenyl)isoquinoline-4-carbonyl]amino]propyl]ammonium Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H29N3O3/c1-4-26(5-2)16-8-15-25-23(28)22-17-27(18-11-13-19(30-3)14-12-18)24(29)21-10-7-6-9-20(21)22/h6-7,9-14,17H,4-5,8,15-16H2,1-3H3,(H,25,28)/p+1