[5,6-bis(azanyl)-1-benzamido-1-oxidanylidene-hexan-2-yl]oxy-pentyl-phosphinic acid

Systemtic Name: [5,6-bis(azanyl)-1-benzamido-1-oxidanylidene-hexan-2-yl]oxy-pentyl-phosphinic acid Openeye Name: [4,5-diamino-1-(benzoylcarbamoyl)pentoxy]-pentyl-phosphinic acid CAS Name: (5,6-diamino-1-benzamido-1-oxohexan-2-yl)oxy-pentylphosphinic acid IUPAC Name: (5,6-diamino-1-benzamido-1-oxohexan-2-yl)oxy-pentylphosphinic acid Traditional Name: amyl-[4,5-diamino-1-(benzoylcarbamoyl)pentoxy]phosphinic acid Formula: C18H30N3O5P MolecularWeight: 399.421661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCP(=O)(O)OC(CCC(CN)N)C(=O)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCP(=O)(O)OC(CCC(CN)N)C(=O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H30N3O5P/c1-2-3-7-12-27(24,25)26-16(11-10-15(20)13-19)18(23)21-17(22)14-8-5-4-6-9-14/h4-6,8-9,15-16H,2-3,7,10-13,19-20H2,1H3,(H,24,25)(H,21,22,23)