[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-(3-propan-2-yloxypropyl)azanium Openeye Name: [2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxo-ethyl]-(3-isopropoxypropyl)ammonium CAS Name: [2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxoethyl]-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxoethyl]-(3-propan-2-yloxypropyl)azanium Traditional Name: [2-[2-(3,4-diethoxyphenyl)ethylamino]-2-keto-ethyl]-(3-isopropoxypropyl)ammonium Formula: C20H35N2O4+ MolecularWeight: 367.5029

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C[NH2+]CCCOC(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C[NH2+]CCCOC(C)C)OCC

InChI

InChI=1S/C20H34N2O4/c1-5-24-18-9-8-17(14-19(18)25-6-2)10-12-22-20(23)15-21-11-7-13-26-16(3)4/h8-9,14,16,21H,5-7,10-13,15H2,1-4H3,(H,22,23)/p+1