6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)tetradecoxy]-5-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-6-oxo-hexanoic acid CAS Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-5-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-6-oxohexanoic acid IUPAC Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-5-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-6-oxohexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)tetradecoxy]-6-keto-5-(naphthionylamino)hexanoic acid Formula: C34H53N3O7S MolecularWeight: 647.86552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

InChI

InChI=1S/C34H53N3O7S/c1-4-5-6-7-8-9-10-11-12-13-14-18-26(25-32(35)38)44-34(41)29(21-17-24-33(39)40)36-45(42,43)31-23-16-19-27-28(31)20-15-22-30(27)37(2)3/h15-16,19-20,22-23,26,29,36H,4-14,17-18,21,24-25H2,1-3H3,(H2,35,38)(H,39,40)