(3-chlorophenyl) N-[3-(1-hexylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamate

Systemtic Name: (3-chlorophenyl) N-[3-(1-hexylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamate Openeye Name: (3-chlorophenyl) N-[3-(1-hexyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamate CAS Name: N-[3-(1-hexyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) N-[3-(1-hexylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamate Traditional Name: N-[3-(1-hexyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamic acid (3-chlorophenyl) ester Formula: C25H31ClN4O2 MolecularWeight: 454.99224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)OC4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)OC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H31ClN4O2/c1-2-3-4-5-13-30-14-11-18(12-15-30)21-17-27-22-9-10-23(28-24(21)22)29-25(31)32-20-8-6-7-19(26)16-20/h6-10,16-18,27H,2-5,11-15H2,1H3,(H,28,29,31)