2-[1-(3-carbamimidoylphenoxy)ethyl]-4-piperidin-1-ylcarbonyl-benzamide

Systemtic Name: 2-[1-(3-carbamimidoylphenoxy)ethyl]-4-piperidin-1-ylcarbonyl-benzamide Openeye Name: 2-[1-(3-carbamimidoylphenoxy)ethyl]-4-(piperidine-1-carbonyl)benzamide CAS Name: 2-[1-(3-carbamimidoylphenoxy)ethyl]-4-[oxo(1-piperidinyl)methyl]benzamide IUPAC Name: 2-[1-(3-carbamimidoylphenoxy)ethyl]-4-(piperidine-1-carbonyl)benzamide Traditional Name: 2-[1-(3-amidinophenoxy)ethyl]-4-(piperidine-1-carbonyl)benzamide Formula: C22H26N4O3 MolecularWeight: 394.46684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)C(=O)N2CCCCC2)C(=O)N)OC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(C1=C(C=CC(=C1)C(=O)N2CCCCC2)C(=O)N)OC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H26N4O3/c1-14(29-17-7-5-6-15(12-17)20(23)24)19-13-16(8-9-18(19)21(25)27)22(28)26-10-3-2-4-11-26/h5-9,12-14H,2-4,10-11H2,1H3,(H3,23,24)(H2,25,27)