(2-methoxyphenyl)methyl-bis[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]azanium

Systemtic Name: (2-methoxyphenyl)methyl-bis[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]azanium Openeye Name: (2-methoxyphenyl)methyl-bis[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium CAS Name: (2-methoxyphenyl)methyl-bis[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium IUPAC Name: (2-methoxyphenyl)methyl-bis[2-oxo-2-(prop-2-ynylamino)ethyl]azanium Traditional Name: bis[2-keto-2-(propargylamino)ethyl]-o-anisyl-ammonium Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH+](CC(=O)NCC#C)CC(=O)NCC#C

Isomeric SMILES

COC1=CC=CC=C1C[NH+](CC(=O)NCC#C)CC(=O)NCC#C

InChI

InChI=1S/C18H21N3O3/c1-4-10-19-17(22)13-21(14-18(23)20-11-5-2)12-15-8-6-7-9-16(15)24-3/h1-2,6-9H,10-14H2,3H3,(H,19,22)(H,20,23)/p+1