N-[3-(3-carbamimidoylphenoxy)propyl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(3-carbamimidoylphenoxy)propyl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-(3-carbamimidoylphenoxy)propyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-(3-carbamimidoylphenoxy)propyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-(3-carbamimidoylphenoxy)propyl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-(3-amidinophenoxy)propyl]isonipecotamide Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)NCCCOC2=CC=CC(=C2)C(=N)N

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)NCCCOC2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C18H26N4O3/c1-13(23)22-9-6-14(7-10-22)18(24)21-8-3-11-25-16-5-2-4-15(12-16)17(19)20/h2,4-5,12,14H,3,6-11H2,1H3,(H3,19,20)(H,21,24)