[cyclopentylmethyl-[4-(quinolin-2-ylmethoxy)phenyl]carbamoyl]-(2-methylphenyl)sulfamic acid

Systemtic Name: [cyclopentylmethyl-[4-(quinolin-2-ylmethoxy)phenyl]carbamoyl]-(2-methylphenyl)sulfamic acid Openeye Name: [cyclopentylmethyl-[4-(2-quinolylmethoxy)phenyl]carbamoyl]-(o-tolyl)sulfamic acid CAS Name: [[N-(cyclopentylmethyl)-4-(2-quinolinylmethoxy)anilino]-oxomethyl]-(2-methylphenyl)sulfamic acid IUPAC Name: [cyclopentylmethyl-[4-(quinolin-2-ylmethoxy)phenyl]carbamoyl]-(2-methylphenyl)sulfamic acid Traditional Name: [cyclopentylmethyl-[4-(2-quinolylmethoxy)phenyl]carbamoyl]-(o-tolyl)sulfamic acid Formula: C30H31N3O5S MolecularWeight: 545.64924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C(=O)N(CC2CCCC2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)S(=O)(=O)O

Isomeric SMILES

CC1=CC=CC=C1N(C(=O)N(CC2CCCC2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)S(=O)(=O)O

InChI

InChI=1S/C30H31N3O5S/c1-22-8-2-7-13-29(22)33(39(35,36)37)30(34)32(20-23-9-3-4-10-23)26-16-18-27(19-17-26)38-21-25-15-14-24-11-5-6-12-28(24)31-25/h2,5-8,11-19,23H,3-4,9-10,20-21H2,1H3,(H,35,36,37)