(2S)-2,6-bis(azanyl)-1-(1-diphenoxyphosphoryl-1,3-dihydroisoindol-2-yl)hexan-1-one

Systemtic Name: (2S)-2,6-bis(azanyl)-1-(1-diphenoxyphosphoryl-1,3-dihydroisoindol-2-yl)hexan-1-one Openeye Name: (2S)-2,6-diamino-1-(1-diphenoxyphosphorylisoindolin-2-yl)hexan-1-one CAS Name: (2S)-2,6-diamino-1-(1-diphenoxyphosphoryl-1,3-dihydroisoindol-2-yl)-1-hexanone IUPAC Name: (2S)-2,6-diamino-1-(1-diphenoxyphosphoryl-1,3-dihydroisoindol-2-yl)hexan-1-one Traditional Name: (2S)-2,6-diamino-1-(1-diphenoxyphosphorylisoindolin-2-yl)hexan-1-one Formula: C26H30N3O4P MolecularWeight: 479.507861

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(N1C(=O)C(CCCCN)N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2C(N1C(=O)[C@H](CCCCN)N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H30N3O4P/c27-18-10-9-17-24(28)25(30)29-19-20-11-7-8-16-23(20)26(29)34(31,32-21-12-3-1-4-13-21)33-22-14-5-2-6-15-22/h1-8,11-16,24,26H,9-10,17-19,27-28H2/t24-,26?/m0/s1