4-(7-chloranylquinolin-4-yl)-N-[(3E)-3-ethoxyiminocycloheptyl]piperazine-1-carboxamide

Systemtic Name: 4-(7-chloranylquinolin-4-yl)-N-[(3E)-3-ethoxyiminocycloheptyl]piperazine-1-carboxamide Openeye Name: 4-(7-chloro-4-quinolyl)-N-[(3E)-3-ethoxyiminocycloheptyl]piperazine-1-carboxamide CAS Name: 4-(7-chloro-4-quinolinyl)-N-[(3E)-3-ethoxyiminocycloheptyl]-1-piperazinecarboxamide IUPAC Name: 4-(7-chloroquinolin-4-yl)-N-[(3E)-3-ethoxyiminocycloheptyl]piperazine-1-carboxamide Traditional Name: 4-(7-chloro-4-quinolyl)-N-[(3E)-3-ethyloximinocycloheptyl]piperazine-1-carboxamide Formula: C23H30ClN5O2 MolecularWeight: 443.9696

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C1CCCCC(C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CCO/N=C/1\CCCCC(C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C23H30ClN5O2/c1-2-31-27-19-6-4-3-5-18(16-19)26-23(30)29-13-11-28(12-14-29)22-9-10-25-21-15-17(24)7-8-20(21)22/h7-10,15,18H,2-6,11-14,16H2,1H3,(H,26,30)/b27-19+