[4-[[4-(2-ethylbutanoylamino)-3-methoxy-phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[4-(2-ethylbutanoylamino)-3-methoxy-phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[4-(2-ethylbutanoylamino)-3-methoxy-anilino]-4-oxo-butyl]ammonium CAS Name: [4-[4-[(2-ethyl-1-oxobutyl)amino]-3-methoxyanilino]-4-oxobutyl]ammonium IUPAC Name: [4-[4-(2-ethylbutanoylamino)-3-methoxyanilino]-4-oxobutyl]azanium Traditional Name: [4-[4-(2-ethylbutanoylamino)-3-methoxy-anilino]-4-keto-butyl]ammonium Formula: C17H28N3O3+ MolecularWeight: 322.42252

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C=C(C=C1)NC(=O)CCC[NH3+])OC

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C=C(C=C1)NC(=O)CCC[NH3+])OC

InChI

InChI=1S/C17H27N3O3/c1-4-12(5-2)17(22)20-14-9-8-13(11-15(14)23-3)19-16(21)7-6-10-18/h8-9,11-12H,4-7,10,18H2,1-3H3,(H,19,21)(H,20,22)/p+1