[3-chloranyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]methyl-cyclopentyl-azanium

Systemtic Name: [3-chloranyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]methyl-cyclopentyl-azanium Openeye Name: [4-(2-anilino-2-oxo-ethoxy)-3-chloro-5-methoxy-phenyl]methyl-cyclopentyl-ammonium CAS Name: [4-(2-anilino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methyl-cyclopentylammonium IUPAC Name: [4-(2-anilino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methyl-cyclopentylazanium Traditional Name: [4-(2-anilino-2-keto-ethoxy)-3-chloro-5-methoxy-benzyl]-cyclopentyl-ammonium Formula: C21H26ClN2O3+ MolecularWeight: 389.89574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]C2CCCC2)Cl)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]C2CCCC2)Cl)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25ClN2O3/c1-26-19-12-15(13-23-16-7-5-6-8-16)11-18(22)21(19)27-14-20(25)24-17-9-3-2-4-10-17/h2-4,9-12,16,23H,5-8,13-14H2,1H3,(H,24,25)/p+1