(4-methyl-1,4-diazepan-4-ium-1-yl)-(3,4,5-triethoxyphenyl)methanone

Systemtic Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(3,4,5-triethoxyphenyl)methanone Openeye Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(3,4,5-triethoxyphenyl)methanone CAS Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(3,4,5-triethoxyphenyl)methanone IUPAC Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(3,4,5-triethoxyphenyl)methanone Traditional Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(3,4,5-triethoxyphenyl)methanone Formula: C19H31N2O4+ MolecularWeight: 351.46044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCC[NH+](CC2)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCC[NH+](CC2)C

InChI

InChI=1S/C19H30N2O4/c1-5-23-16-13-15(14-17(24-6-2)18(16)25-7-3)19(22)21-10-8-9-20(4)11-12-21/h13-14H,5-12H2,1-4H3/p+1