2-[3-chloranyl-5-[cyclopentyl(3-pyrrolidin-1-ylpropyl)carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid

Systemtic Name: 2-[3-chloranyl-5-[cyclopentyl(3-pyrrolidin-1-ylpropyl)carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid Openeye Name: 2-[3-chloro-5-[cyclopentyl(3-pyrrolidin-1-ylpropyl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid CAS Name: 2-[3-chloro-5-[[cyclopentyl-[3-(1-pyrrolidinyl)propyl]amino]-oxomethyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid IUPAC Name: 2-[3-chloro-5-[cyclopentyl(3-pyrrolidin-1-ylpropyl)carbamoyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid Traditional Name: 2-[3-chloro-5-[cyclopentyl(3-pyrrolidinopropyl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid Formula: C27H35ClN4O4 MolecularWeight: 515.0442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CCCN2CCCC2)C(=O)C3=CC(=CC(=C3)Cl)OCCN(C4=CC=NC=C4)C(=O)O

Isomeric SMILES

C1CCC(C1)N(CCCN2CCCC2)C(=O)C3=CC(=CC(=C3)Cl)OCCN(C4=CC=NC=C4)C(=O)O

InChI

InChI=1S/C27H35ClN4O4/c28-22-18-21(19-25(20-22)36-17-16-32(27(34)35)24-8-10-29-11-9-24)26(33)31(23-6-1-2-7-23)15-5-14-30-12-3-4-13-30/h8-11,18-20,23H,1-7,12-17H2,(H,34,35)