6-[(4-nitrophenyl)sulfonyl-[1-(phenylmethyl)acridin-9-yl]carbonyl-amino]hexanoic acid

Systemtic Name: 6-[(4-nitrophenyl)sulfonyl-[1-(phenylmethyl)acridin-9-yl]carbonyl-amino]hexanoic acid Openeye Name: 6-[(1-benzylacridine-9-carbonyl)-(4-nitrophenyl)sulfonyl-amino]hexanoic acid CAS Name: 6-[(4-nitrophenyl)sulfonyl-[oxo-[1-(phenylmethyl)-9-acridinyl]methyl]amino]hexanoic acid IUPAC Name: 6-[(1-benzylacridine-9-carbonyl)-(4-nitrophenyl)sulfonylamino]hexanoic acid Traditional Name: 6-[(1-benzylacridine-9-carbonyl)-nosyl-amino]hexanoic acid Formula: C33H29N3O7S MolecularWeight: 611.66426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC3=NC4=CC=CC=C4C(=C32)C(=O)N(CCCCCC(=O)O)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC3=NC4=CC=CC=C4C(=C32)C(=O)N(CCCCCC(=O)O)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C33H29N3O7S/c37-30(38)16-5-2-8-21-35(44(42,43)26-19-17-25(18-20-26)36(40)41)33(39)32-27-13-6-7-14-28(27)34-29-15-9-12-24(31(29)32)22-23-10-3-1-4-11-23/h1,3-4,6-7,9-15,17-20H,2,5,8,16,21-22H2,(H,37,38)