carbamimidoyl-cyano-(4-fluorophenyl)carbonyl-methyl-azanium; 1-cyclobutylpiperidine

Systemtic Name: carbamimidoyl-cyano-(4-fluorophenyl)carbonyl-methyl-azanium; 1-cyclobutylpiperidine Openeye Name: carbamimidoyl-cyano-(4-fluorobenzoyl)-methyl-ammonium; 1-cyclobutylpiperidine CAS Name: carbamimidoyl-cyano-[(4-fluorophenyl)-oxomethyl]-methylammonium; 1-cyclobutylpiperidine IUPAC Name: carbamimidoyl-cyano-(4-fluorobenzoyl)-methylazanium; 1-cyclobutylpiperidine Traditional Name: amidino-cyano-(4-fluorobenzoyl)-methyl-ammonium; 1-cyclobutylpiperidine Formula: C19H27FN5O+ MolecularWeight: 360.448983

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C#N)(C(=O)C1=CC=C(C=C1)F)C(=N)N.C1CCN(CC1)C2CCC2

Isomeric SMILES

C[N+](C#N)(C(=O)C1=CC=C(C=C1)F)C(=N)N.C1CCN(CC1)C2CCC2

InChI

InChI=1S/C10H10FN4O.C9H17N/c1-15(6-12,10(13)14)9(16)7-2-4-8(11)5-3-7;1-2-7-10(8-3-1)9-5-4-6-9/h2-5H,1H3,(H3,13,14);9H,1-8H2/q+1;