[3-chloranyl-4-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-phenyl]methylazanium

Systemtic Name: [3-chloranyl-4-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-phenyl]methylazanium Openeye Name: [3-chloro-4-[2-(cyclopropylmethylamino)-2-oxo-ethoxy]-5-methoxy-phenyl]methylammonium CAS Name: [3-chloro-4-[2-(cyclopropylmethylamino)-2-oxoethoxy]-5-methoxyphenyl]methylammonium IUPAC Name: [3-chloro-4-[2-(cyclopropylmethylamino)-2-oxoethoxy]-5-methoxyphenyl]methylazanium Traditional Name: [3-chloro-4-[2-(cyclopropylmethylamino)-2-keto-ethoxy]-5-methoxy-benzyl]ammonium Formula: C14H20ClN2O3+ MolecularWeight: 299.7732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH3+])Cl)OCC(=O)NCC2CC2

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH3+])Cl)OCC(=O)NCC2CC2

InChI

InChI=1S/C14H19ClN2O3/c1-19-12-5-10(6-16)4-11(15)14(12)20-8-13(18)17-7-9-2-3-9/h4-5,9H,2-3,6-8,16H2,1H3,(H,17,18)/p+1