cyclohexyl-[3-[(3-ethoxycarbonyl-5-ethyl-thiophen-2-yl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: cyclohexyl-[3-[(3-ethoxycarbonyl-5-ethyl-thiophen-2-yl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: cyclohexyl-[3-[(3-ethoxycarbonyl-5-ethyl-2-thienyl)amino]-3-oxo-propyl]ammonium CAS Name: cyclohexyl-[3-[(3-ethoxycarbonyl-5-ethyl-2-thiophenyl)amino]-3-oxopropyl]ammonium IUPAC Name: cyclohexyl-[3-[(3-ethoxycarbonyl-5-ethylthiophen-2-yl)amino]-3-oxopropyl]azanium Traditional Name: [3-[(3-carbethoxy-5-ethyl-2-thienyl)amino]-3-keto-propyl]-cyclohexyl-ammonium Formula: C18H29N2O3S+ MolecularWeight: 353.49946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CC[NH2+]C2CCCCC2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CC[NH2+]C2CCCCC2)C(=O)OCC

InChI

InChI=1S/C18H28N2O3S/c1-3-14-12-15(18(22)23-4-2)17(24-14)20-16(21)10-11-19-13-8-6-5-7-9-13/h12-13,19H,3-11H2,1-2H3,(H,20,21)/p+1