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

Systemtic Name: [3-chloranyl-4-[2-(cyclopentylamino)-2-oxidanylidene-ethoxy]-5-methoxy-phenyl]methylazanium Openeye Name: [3-chloro-4-[2-(cyclopentylamino)-2-oxo-ethoxy]-5-methoxy-phenyl]methylammonium CAS Name: [3-chloro-4-[2-(cyclopentylamino)-2-oxoethoxy]-5-methoxyphenyl]methylammonium IUPAC Name: [3-chloro-4-[2-(cyclopentylamino)-2-oxoethoxy]-5-methoxyphenyl]methylazanium Traditional Name: [3-chloro-4-[2-(cyclopentylamino)-2-keto-ethoxy]-5-methoxy-benzyl]ammonium Formula: C15H22ClN2O3+ MolecularWeight: 313.79978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH3+])Cl)OCC(=O)NC2CCCC2

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH3+])Cl)OCC(=O)NC2CCCC2

InChI

InChI=1S/C15H21ClN2O3/c1-20-13-7-10(8-17)6-12(16)15(13)21-9-14(19)18-11-4-2-3-5-11/h6-7,11H,2-5,8-9,17H2,1H3,(H,18,19)/p+1