N-(6-azanyl-1-diphenoxyphosphoryl-hexyl)-1-(3-phenoxyphenyl)carbonyl-pyrrolidine-2-carboxamide hydrochloride

Systemtic Name: N-(6-azanyl-1-diphenoxyphosphoryl-hexyl)-1-(3-phenoxyphenyl)carbonyl-pyrrolidine-2-carboxamide hydrochloride Openeye Name: N-(6-amino-1-diphenoxyphosphoryl-hexyl)-1-(3-phenoxybenzoyl)pyrrolidine-2-carboxamide hydrochloride CAS Name: N-(6-amino-1-diphenoxyphosphorylhexyl)-1-[oxo-(3-phenoxyphenyl)methyl]-2-pyrrolidinecarboxamide hydrochloride IUPAC Name: N-(6-amino-1-diphenoxyphosphorylhexyl)-1-(3-phenoxybenzoyl)pyrrolidine-2-carboxamide hydrochloride Traditional Name: N-(6-amino-1-diphenoxyphosphoryl-hexyl)-1-(3-phenoxybenzoyl)pyrrolidine-2-carboxamide hydrochloride Formula: C36H41ClN3O6P MolecularWeight: 678.154001

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)NC(CCCCCN)P(=O)(OC4=CC=CC=C4)OC5=CC=CC=C5.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)NC(CCCCCN)P(=O)(OC4=CC=CC=C4)OC5=CC=CC=C5.Cl

InChI

InChI=1S/C36H40N3O6P.ClH/c37-25-12-4-11-24-34(46(42,44-30-18-7-2-8-19-30)45-31-20-9-3-10-21-31)38-35(40)33-23-14-26-39(33)36(41)28-15-13-22-32(27-28)43-29-16-5-1-6-17-29;/h1-3,5-10,13,15-22,27,33-34H,4,11-12,14,23-26,37H2,(H,38,40);1H